ピーク情報

トマト Micro-Tom 成熟果実の果皮

neg

Peak #3353 MN MID: SE203_S11_M91

m/z: 353.08788, RT: 36.28, 強度: 314402, ログ強度: 2.05, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 8

DB検索結果: (9 names) Scopolin;1-Caffeoylquinic acid;Magnolioside;Cryptochlorogenic acid;7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone;Chlorogenic acid;Biflorin;Isobiflorin;Chrysolandol

DBごとのヒット数: ALL 9 KG 3 KN 6

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	0.211	Scopolin	HMDB: HMDB0303366 KEGG: C01527 KNApSAcK: C00002500
C16H18O9	354.09508	0.211	1-(3,4-Dihydroxycinnamoyl)quinic acid	HMDB: HMDB0030652, HMDB0304633 KNApSAcK: C00055231
C16H18O9	354.09508	0.211	Magnolioside	KNApSAcK: C00053451
C16H18O9	354.09508	0.211	trans-4-Caffeoylquinic acid	HMDB: HMDB0030653 KNApSAcK: C00029540, C00053843
C16H18O9	354.09508	0.211	7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone	KNApSAcK: C00055698
C16H18O9	354.09508	0.211	Chlorogenate	HMDB: HMDB0003164, HMDB0029278, HMDB0032849, HMDB0040690, HMDB0240477, HMDB0242450 KEGG: C00852, C17147 KNApSAcK: C00002724, C00030807, C00039428, C00049091, C00052976, C00054083, C00055767
C16H18O9	354.09508	0.211	Isobiflorin	HMDB: HMDB0040632 KNApSAcK: C00030518
C16H18O9	354.09508	0.211	Biflorin	HMDB: HMDB0002336 KEGG: C08996 KNApSAcK: C00002417
C16H18O9	354.09508	0.211	Chrysolandol	KNApSAcK: C00015105

MSnスペクトル情報

Level: 2, プリカーサーm/z: 353.08746

Splash: splash10-00fr-0900000000-b27a870c4ac30414baac

m/z	Int.	NL	Rel.Int.
173.01	226126	180	1000
179.02	135095	174	597
191.12	36835	162	162
134.99	11464	218	50

Level: 3, プリカーサーm/z: 178.97314

Splash: splash10-001i-0900000000-a20406bbe0fc4e4dd03a

m/z	Int.	NL	Rel.Int.
134.93	52260	44	1000

Level: 3, プリカーサーm/z: 172.99448

Splash: splash10-01ox-9700000000-6bc9d6b8cf625dfa9e2c

m/z	Int.	NL	Rel.Int.
92.98	15990	80	1000
110.89	11083	62	693
70.84	3594	102	224
154.98	2587	18	161
108.99	1627	64	101
58.84	958	114	59
137.07	957	36	59

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