ピーク情報

パセリ　根

neg

Peak #2518 MN MID: SE61_S24_M91

m/z: 431.11926, RT: 30.11, 強度: 35402, ログ強度: 1.13, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 4

DB検索結果: (7 names) 5-(1,1-Dihydroxythiazinan-2-yl)-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide;Griselinoside;Licoagroside B;6-O-Acetylscandoside;Asperulosidic acid;Apiosylglucosyl 4-hydroxybenzo...

DBごとのヒット数: ALL 7 KN 5 HM 2

FlavonoidSearch最大スコア MS2: -, MS3: -

組成式	分子量	誤差(Δppm）	候補化合物名（代表で最短名を記載）	化合物ID
C20H21O4N4SF	432.12675	-0.504	5-(1,1-Dihydroxythiazinan-2-yl)-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide	HMDB: HMDB0257960
C18H24O12	432.12678	-0.554	Tachiogroside B	HMDB: HMDB0036523 KNApSAcK: C00019031
C18H24O12	432.12678	-0.554	Griselinoside	KNApSAcK: C00010550
C18H24O12	432.12678	-0.554	6-O-Acetylscandoside	KNApSAcK: C00032672, C00036635
C18H24O12	432.12678	-0.554	Asperulosidic acid	HMDB: HMDB0248668 KNApSAcK: C00029749
C18H24O12	432.12678	-0.554	Apiosylglucosyl 4-hydroxybenzoate	HMDB: HMDB0035318
C18H24O12	432.12678	-0.554	Linderofruticoside B	KNApSAcK: C00030675

MSnスペクトル情報

Level: 2, プリカーサーm/z: 431.11911

Splash: splash10-000i-0920000000-cefe449c0c674fb388f9

m/z	Int.	NL	Rel.Int.
136.94	10832	294	1000
299.24	2110	132	194
179.03	1040	252	95
293.24	786	138	72
311.07	616	120	56
337.23	567	94	52
191.07	566	240	52

Level: 3, プリカーサーm/z: 136.94687

Splash: splash10-0006-9000000000-97e7c5a8e2478fd75304

m/z	Int.	NL	Rel.Int.
92.92	1875	44	1000

Level: 3, プリカーサーm/z: 299.05920

Splash: splash10-000i-0900000000-bdc6610bf0429357e47b

m/z	Int.	NL	Rel.Int.
136.92	165	162	1000

関連ピーク情報

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	共有数
	30.10	477.12465	46.0054	1.29	[M+HCOOH-H]-	(7 names) 5-(1,1-Dihydroxythiazinan-2-yl)-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide; Griselinoside; Licoagroside B; 6-O-Acetylscandoside; Asperulosidic acid; Apiosylglucosyl 4-hydroxybenzo...	ALL 7 KN 5 HM 2		3
2518	30.11	431.11926	0.0000	1.13	[M-H]-	(7 names) 5-(1,1-Dihydroxythiazinan-2-yl)-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide; Griselinoside; Licoagroside B; 6-O-Acetylscandoside; Asperulosidic acid; Apiosylglucosyl 4-hydroxybenzo...	ALL 7 KN 5 HM 2	MS2 MS3 x 2	4

ピーク情報

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MSnスペクトル情報

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