ピーク情報

＜調味料類＞（食酢類）穀物酢

pos

Peak #4057 MN MID: SE121_S170151_M90

m/z: 485.26094, RT: 39.42, 強度: 85885, ログ強度: 1.43, アダクト: [M+C2H6N2+IsoProp+H]+, 共有数（同様のピークを含むサンプル数）: 4

DB検索結果: (4 names) 1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate;Tryptophan 2-C-mannoside;Semilepidinoside B;2-iodohexadecanal

DBごとのヒット数: ALL 4 KN 1 HM 2 LM 1

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
C17H22O7N2	366.14270	0.956	1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate	HMDB: HMDB0012492
C17H22O7N2	366.14270	0.956	Tryptophan 2-C-mannoside	HMDB: HMDB0240296, HMDB0258059
C17H22O7N2	366.14270	0.956	Semilepidinoside B	HMDB: HMDB0033108 KNApSAcK: C00028988
C16H31OI	366.14196	2.970	2-iodohexadecanal	LipidMAPS: LMFA06000281

MSnスペクトル情報

Level: 2, プリカーサーm/z: 485.26028

Splash: splash10-0006-0190000000-a0c4054074d9aabd618d

m/z	Int.	NL	Rel.Int.
243.07	18449	242	1000
197.03	3174	288	172

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Dihydrochalcone]-A(2OH, 1OMe, 1(2x2-hydroxybenzyl))-B(none)	Dihydrochalcone	Angoluvarin
[Dihydrochalcone]-A(2OH, 1OMe, 1(2-Hydroxybenzyl), 1(2-Hydroxybenzyl))-B(none)	Dihydrochalcone	Diuvaretin
[Flavanone]-A(1OH, 1(1(O-Cinnamoyl)-2,2-Dimethyl-3-hydroxytetrahydro-4-furanyl))-B(none)	Flavanone	Tephrorin B

Level: 3, プリカーサーm/z: 243.06509

Splash: splash10-0002-0930000000-62ee4958da15439db4a6

m/z	Int.	NL	Rel.Int.
197.08	2952	46	1000
225.01	1187	18	402
132.07	261	111	88

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Isoflavan]-A(1OH)-B(1OH)	Isoflavan	Equol
[Dihydrochalcone]-A(2OH)-B(none)	Dihydrochalcone	2',4'-Dihydroxydihydrochalcone
[Flavan]-A(1OH)-B(1OH)	Flavan	7,4'-Dihydroxyflavan
[Flavan]-A(2OH)-B(none)	Flavan	5,7-Dihydroxyflavan
[2-Phenylbenzofuran]-A(1OH)-B(2OH)	2-Phenylbenzofuran	6,2',4'-Trihydroxy-2-phenylbenzofuran

Level: 3, プリカーサーm/z: 197.03140

Splash: splash10-004i-0900000000-2dd0452f9e4ad1a8bb0e

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果