SE227:/

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lower pageS001, S002, S003, S004, S005, S006, S007, S008, S009, S010, S011, S012, S013, S014, S015, S016, S017, S018, S019, S020, S021, S022, S023, S024, S025, S026, S027, S028, S029, S030, S031, S032, S033, S034, S035, S036, S037, S038, S039, S040, S041, S042, S043, S044, S045, S046, S047, S048, S049, S050, S051, S052, S053, S054, S055, S056, S057, S058, S059, S060, S061, S062, S063, S064, S065, S066, S067, S068, S069, S070, S071, S072, S073, S074, S075, S076, S077, S078, S079, S080, S081, S082, S083, S084, S085, S086, S087, S088, S089, S090, S091, S092, S093, S094, S095, S096, S097, S098, S099, S100, S101, S102, S103, S104, S105, S106, S107, S108, S109, S110, S111, S112, S113, S114, S115, S116, S117, S118, S119, S120, S121, S901, S902, S903

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Sample Set Information

ID	SE227
Title	LC-MS based untargeted metabolome analysis of various samples
Description	Compounds in various samples were analyzed using liquid chromatography-mass spectrometry (LC-MS). The same analytical conditions are applied to all samples. Therefore, the compound peaks can be compared to each other by the mass values, the retention time of the LC, and the CID mass spectrum. The data were obtained for the construction of the “Thing Metabolome Repository” website (http://metabolites.in/things).
Authors	Nozomu Sakurai (National Institute of Genetics, Kazusa DNA Research Institute, email: sakurai (at) kazusa.or.jp)
Reference	The Thing Metabolome Repository family (XMRs): comparable untargeted metabolome databases for analyzing sample-specific unknown metabolites. Sakurai N, Yamazaki S, Suda K, Hosoki A, Akimoto N, Takahashi H, Shibata D and Aoki Y, Nucleic Acids Research Database Issue) 51 (D1): D660-D677 (2023), DOI: 10.1093/nar/gkac1058
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SE227 : [ LC-MS based untargeted metabolome analysis of various samples ]
- S001 : [ Kampo stomach medicine 1 / 漢方胃腸薬1 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S002 : [ Kampo stomach medicine 2 / 漢方胃腸薬2 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S003 : [ Kampo folk medicine / 漢方民間薬 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S004 : [ Kampo troche / 漢方のど飴 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S005 : [ Barley drink 1 / 青汁1 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S006 : [ Barley drink 2 / 青汁2 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S007 : [ Barley drink 3 / 青汁3 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S008 : [ Dalmatian chrysanthemum (NBRP YSY01), Leaf / シロバナムシヨケギク（NBRP YSY01), 葉 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S009 : [ Dalmatian chrysanthemum (NBRP YSY01), Flower / シロバナムシヨケギク（NBRP YSY01), 花 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S010 : [ Iwainchin (a kind of chrysanthemum, NBRP AMJ06), Leaf / イワインチン (NBRP AMJ06), 葉 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S011 : [ Iwainchin (a kind of chrysanthemum, NBRP AMJ06), Flower / イワインチン (NBRP AMJ06), 花 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S012 : [ Pireo-giku (a kind of chrysanthemum, NBRP YCF01), Leaf / ピレオギク (NBRP YCF01), 葉 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S013 : [ Pireo-giku (a kind of chrysanthemum, NBRP YCF01), Flower / ピレオギク (NBRP YCF01), 花 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S014 : [ Mosquito repellent 1 / 蚊取り線香1 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S015 : [ Mosquito repellent 2 / 蚊取り線香2 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S016 : [ Mosquito repellent, ash 1 / 蚊取り線香燃焼後の灰1 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S017 : [ Mosquito repellent, ash 2 / 蚊取り線香燃焼後の灰2 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S018 : [ Oat, Seed / オーツ麦（エンバク）, 種子 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S019 : [ Umiuchiwa seaweed, Sea-fan / ウミウチワ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S020 : [ Nebarimo seaweed / ネバリモ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S021 : [ Iroro seaweed / イロロ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S022 : [ Ishige seaweed / イシゲ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S023 : [ Wakame seaweed (young), Frond (young) / ワカメ, 幼体の葉状部 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S024 : [ Wakame seaweed, Fertile frond (young) / ワカメ, 幼体の胞子葉（メカブ） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S025 : [ Wakame seaweed, Fertile frond / ワカメ, 胞子葉（メカブ） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S026 : [ Arame seaweed, Frond / アラメ, 葉状部 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S027 : [ Arame seaweed, Axis / アラメ, 茎状部 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S028 : [ Akamoku seaweed / アカモク ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S029 : [ Akamoku seaweed, Alga body with many female reproductive organs / アカモク, 雌性生殖器が多い藻体 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S030 : [ Akamoku seaweed, Alga body with many air bladders / アカモク, 気胞が多い藻体 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S031 : [ Unkeito (Extract Granules) / 温経湯（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S032 : [ Goshajinkigan (Extract Granules) / 牛車腎気丸（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S033 : [ Ninjin'yoeito (Extract Granules) / 人参養栄湯（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S034 : [ Shosaikotokakikyosekko (Extract Granules) / 小柴胡湯加桔梗石膏（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S035 : [ Hijiki seaweed / ヒジキ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S036 : [ Hijiki seaweed, Alga body (young) / ヒジキ, 幼体 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S037 : [ Oobamoku seaweed / オオバモク ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S038 : [ Oobamoku seaweed, Axis / オオバモク, 茎状部 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S039 : [ Hiranejimoku seaweed / ヒラネジモク ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S040 : [ Narasamo seaweed / ナラサモ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S041 : [ Umitoranoo seaweed / ウミトラノオ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S042 : [ Heritorikaninote seaweed, / ヘリトリカニノテ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S043 : [ Pirihiba seaweed 1 / ピリヒバ1 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S044 : [ Pirihiba seaweed 2 / ピリヒバ2 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S045 : [ Pirihiba seaweed 3 / ピリヒバ3 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S046 : [ Sabimodoki seaweed / サビモドキ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S047 : [ Pickled scallions / らっきょう酢漬け ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S048 : [ Black garlic / 黒にんにく ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S049 : [ Rikkosan (Extract Granules) / 立効散（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S050 : [ Medium (for Duckweed, Lemna aequinoctialis) / 培地（アオウキクサ用） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S051 : [ Duckweed, Aceptic culture, 10 days / アオウキクサ, 無菌培養10日目 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S052 : [ Seishinrenshiin (Extract Granules) / 清心蓮子飲（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S053 : [ Chinese caterpillar fungus product 1 / トウチュウカソウ（冬虫夏草）製品1 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S054 : [ Chinese caterpillar fungus product 2 / トウチュウカソウ（冬虫夏草）製品2 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S055 : [ Chinese caterpillar fungus product 3 / トウチュウカソウ（冬虫夏草）製品3 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S056 : [ Chinese caterpillar fungus product 4 / トウチュウカソウ（冬虫夏草）製品4 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S057 : [ Standard Adenine / 精製標品アデニン（Adenine） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S058 : [ Standard mix. / 精製標品混合物 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S059 : [ Standard Guanine / 精製標品グアニン（Guanine） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S060 : [ Standard Adenosine / 精製標品アデノシン (Adenosine) ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S061 : [ Standard mix. / 精製標品混合物 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S062 : [ Standard 2'-Deoxyadenosine / 精製標品 2'-デオキシアデノシン (2'-Deoxyadenosine) ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S063 : [ Standard Cordycepin; 3'-Deoxyadenosine / 精製標品コルジセピン; 3'-デオキシアデノシン (Cordycepin; 3'-Deoxyadenosine) ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S064 : [ Standard mix. / 精製標品混合物 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S065 : [ Standard mix. / 精製標品混合物 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S066 : [ Choreitogoshimotsuto (Extract Granules) / 猪苓湯合四物湯（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S067 : [ Maoukaninote seaweed / マオウカニノテ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S068 : [ Musetsusangomo seaweed / 無節サンゴモ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S069 : [ Makusa seaweed 1 / マクサ1 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S070 : [ Makusa seaweed 2 / マクサ2 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S071 : [ Onikusa seaweed / オニクサ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S072 : [ Hanafunori seaweed / ハナフノリ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S073 : [ Fukurofunori seaweed / フクロフノリ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S074 : [ Suginori seaweed / スギノリ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S075 : [ Kainori seaweed / カイノリ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S076 : [ Ibotsunomata seaweed, Alga body (young) without cysts / イボツノマタ, 若く嚢果のない藻体 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S077 : [ San'oshashinto (Extract Granules) / 三黄瀉心湯（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S078 : [ Standard (+)-Limonene / 精製標品 (+)-リモネン ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S079 : [ Standard (-)-Limonene / 精製標品 (-)-リモネン ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S080 : [ Standard (-)-Menthol / 精製標品 (-)-メントール ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S081 : [ Standard Vincristine / 精製標品ビンクリスチン ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S082 : [ Standard Capsaicin / 精製標品カプサイシン ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S083 : [ Saireito (Extract Granules) / 柴苓湯（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S084 : [ Ibotsunomata seaweed, Alga body (greenish) / イボツノマタ, 緑色の藻体 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S085 : [ Ibotsunomata seaweed, Alga body with cysts / イボツノマタ, 嚢果のついた藻体 ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S086 : [ Kagiibaranori seaweed / カギイバラノリ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S087 : [ Hanesaimi seaweed / ハネサイミ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S088 : [ Harigane seaweed / ハリガネ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S089 : [ Hosobanaminohana seaweed / ホソバナミノハナ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S090 : [ Kintoki seaweed / キントキ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S091 : [ Matsunori seaweed / マツノリ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S092 : [ Hizirimen seaweed / ヒヂリメン ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S093 : [ Tanbanori seaweed / タンバノリ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S094 : [ Ireito (Extract Granules) / 胃苓湯（エキス顆粒） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S095 : [ Red pepper, Fruit (dried) / トウガラシ, 果実（タカノツメ、乾燥） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S096 : [ Habanero chilli (dried powder) / ハバネロペッパー（乾燥粉末） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S097 : [ Japanese pepper (dried powder) / 山椒（乾燥粉末）サンショウ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S098 : [ Sichuan pepper (dried powder) / 花椒（乾燥粉末）カショウ、ハナショウ、カホクザンショウ ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S099 : [ Ylang ylang, Flower (Essential oil) / イランイラン, 花（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S100 : [ Clary sage, Flower, Leaf (Essential oil) / クラリセージ, 花・葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S101 : [ Grapefruit, Peel (Essential oil) / グレープフルーツ, 果皮（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S102 : [ Juniperberry, Fruit (Essential oil) / ジュニパーベリー, 果実（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S103 : [ Sweet orange, Peel (Essential oil) / スイートオレンジ, 果皮（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S104 : [ Sweet marjoram, Leaf (Essential oil) / スイートマジョラム, 葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S105 : [ Geranium, Flower, Leaf (Essential oil) / ゼラニウム, 花・葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S106 : [ Tea tree, Leaf (Essential oil) / ティーツリー, 葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S107 : [ Frankincense, Resin (Essential oil) / フランキンセンス, 樹脂（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S108 : [ Peppermint, Leaf (Essential oil) / ペパーミント, 葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S109 : [ Bergamot, Peel (Essential oil) / ベルガモット, 果皮（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S110 : [ Eucalyptus, Leaf (Essential oil) / ユーカリ, 葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S111 : [ Lavender, Flower, Leaf (Essential oil) / ラベンダー, 花・葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S112 : [ Lemon, Peel (Essential oil) / レモン, 果皮（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S113 : [ Lemongrass, Leaf (Essential oil) / レモングラス, 葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S114 : [ Rosemary cineole, Leaf (Essential oil) / ローズマリーシネオール, 葉（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S115 : [ Roman Chamomile, Flower (Essential oil) / ローマンカモミール, 花（精油） ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S116 : [ Standard beta-Citronellol / 精製標品 β-シトロネロール ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S117 : [ Standard Geraniol / 精製標品ゲラニオール ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S118 : [ Standard Linalool / 精製標品リナロール ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S119 : [ Standard Citral / 精製標品シトラール ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S120 : [ Standard Nerol / 精製標品ネロール ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S121 : [ Standard alpha-Terpineol / 精製標品 α-テルピネオール ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M90 : [ PSEUDO: Positive, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
  - M91 : [ PSEUDO: Negative, A set of analyses for valid peak selection. ]
    - D9 : [ Valid peak detection and characterization ]
- S901 : [ Mock ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M02 : [ LC-QTOF-MS, ESI, Positive ]
  - M03 : [ LC-QTOF-MS, ESI, Positive ]
  - M04 : [ LC-QTOF-MS, ESI, Positive ]
  - M05 : [ LC-QTOF-MS, ESI, Positive ]
  - M06 : [ LC-QTOF-MS, ESI, Positive ]
  - M08 : [ LC-QTOF-MS, ESI, Positive ]
  - M09 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M12 : [ LC-QTOF-MS, ESI, Negative ]
  - M13 : [ LC-QTOF-MS, ESI, Negative ]
  - M14 : [ LC-QTOF-MS, ESI, Negative ]
  - M15 : [ LC-QTOF-MS, ESI, Negative ]
  - M16 : [ LC-QTOF-MS, ESI, Negative ]
  - M18 : [ LC-QTOF-MS, ESI, Negative ]
  - M19 : [ LC-QTOF-MS, ESI, Negative ]
- S902 : [ Mock ]
  - M01 : [ LC-QTOF-MS, ESI, Positive ]
  - M02 : [ LC-QTOF-MS, ESI, Positive ]
  - M03 : [ LC-QTOF-MS, ESI, Positive ]
  - M04 : [ LC-QTOF-MS, ESI, Positive ]
  - M05 : [ LC-QTOF-MS, ESI, Positive ]
  - M06 : [ LC-QTOF-MS, ESI, Positive ]
  - M11 : [ LC-QTOF-MS, ESI, Negative ]
  - M12 : [ LC-QTOF-MS, ESI, Negative ]
  - M13 : [ LC-QTOF-MS, ESI, Negative ]
  - M14 : [ LC-QTOF-MS, ESI, Negative ]
  - M15 : [ LC-QTOF-MS, ESI, Negative ]
  - M16 : [ LC-QTOF-MS, ESI, Negative ]
- S903 : [ Mock ]
  - M001 : [ LC-QTOF-MS, ESI, Positive ]
  - M002 : [ LC-QTOF-MS, ESI, Positive ]
  - M003 : [ LC-QTOF-MS, ESI, Positive ]
  - M004 : [ LC-QTOF-MS, ESI, Positive ]
  - M005 : [ LC-QTOF-MS, ESI, Positive ]
  - M006 : [ LC-QTOF-MS, ESI, Positive ]
  - M007 : [ LC-QTOF-MS, ESI, Positive ]
  - M008 : [ LC-QTOF-MS, ESI, Positive ]
  - M009 : [ LC-QTOF-MS, ESI, Positive ]
  - M010 : [ LC-QTOF-MS, ESI, Positive ]
  - M011 : [ LC-QTOF-MS, ESI, Positive ]
  - M012 : [ LC-QTOF-MS, ESI, Positive ]
  - M018 : [ LC-QTOF-MS, ESI, Negative ]
  - M101 : [ LC-QTOF-MS, ESI, Negative ]
  - M102 : [ LC-QTOF-MS, ESI, Negative ]
  - M103 : [ LC-QTOF-MS, ESI, Negative ]
  - M104 : [ LC-QTOF-MS, ESI, Negative ]
  - M105 : [ LC-QTOF-MS, ESI, Negative ]
  - M106 : [ LC-QTOF-MS, ESI, Negative ]
  - M107 : [ LC-QTOF-MS, ESI, Negative ]
  - M109 : [ LC-QTOF-MS, ESI, Negative ]
  - M110 : [ LC-QTOF-MS, ESI, Negative ]
  - M111 : [ LC-QTOF-MS, ESI, Negative ]
  - M112 : [ LC-QTOF-MS, ESI, Negative ]
- SS1 : [ Homogenated and stored at -80 C ]
- MS01 : [ LC-Q-Tof-MS, ESI, Positive ]
- MS11 : [ LC-Q-Tof-MS, ESI, Negative ]
- DS1 : [ Peak detection, alignment and characterization using PowerGetBatch ]
- AM1 : [ Characterization by compound database search and FlavonoidSearch ]

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