ピーク情報

トマト Micro-Tom 成熟果実の果皮

neg

Peak #3498 MN MID: SE203_S11_M91

m/z: 707.18182, RT: 36.77, 強度: 1642960, ログ強度: 2.77, アダクト: [2M-H]-, 共有数（同様のピークを含むサンプル数）: 7

DB検索結果: (10 names) Scopolin;1-Caffeoylquinic acid;Magnolioside;Cryptochlorogenic acid;7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone;Chlorogenic acid;Biflorin;Isobiflorin;Chrysolandol;1-Methyl-3-{2-[(1-methyl-1H-benzi...

DBごとのヒット数: ALL 10 KG 3 KN 6 HM 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
C16H18O9	354.09508	-1.503	Scopolin	HMDB: HMDB0303366 KEGG: C01527 KNApSAcK: C00002500
C16H18O9	354.09508	-1.503	1-(3,4-Dihydroxycinnamoyl)quinic acid	HMDB: HMDB0030652, HMDB0304633 KNApSAcK: C00055231
C16H18O9	354.09508	-1.503	Magnolioside	KNApSAcK: C00053451
C16H18O9	354.09508	-1.503	trans-4-Caffeoylquinic acid	HMDB: HMDB0030653 KNApSAcK: C00029540, C00053843
C16H18O9	354.09508	-1.503	7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone	KNApSAcK: C00055698
C16H18O9	354.09508	-1.503	Chlorogenate	HMDB: HMDB0003164, HMDB0029278, HMDB0032849, HMDB0040690, HMDB0240477, HMDB0242450 KEGG: C00852, C17147 KNApSAcK: C00002724, C00030807, C00039428, C00049091, C00052976, C00054083, C00055767
C16H18O9	354.09508	-1.503	Isobiflorin	HMDB: HMDB0040632 KNApSAcK: C00030518
C16H18O9	354.09508	-1.503	Biflorin	HMDB: HMDB0002336 KEGG: C08996 KNApSAcK: C00002417
C16H18O9	354.09508	-1.503	Chrysolandol	KNApSAcK: C00015105

MSnスペクトル情報

Level: 2, プリカーサーm/z: 707.18109

Splash: splash10-0udi-0009000000-28351b96546903267b1b

m/z	Int.	NL	Rel.Int.
353.15	110077	354	1000

Level: 3, プリカーサーm/z: 353.14844

Splash: splash10-0006-0900000000-01a33a0ee35231798b44

m/z	Int.	NL	Rel.Int.
191.03	50978	162	1000
173.08	19802	180	388
179.09	12820	174	251

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果