ピーク情報

トマト Micro-Tom 成熟果実の果皮

neg

Peak #4119 MN MID: SE203_S11_M91

m/z: 353.08786, RT: 38.86, 強度: 28013, ログ強度: 1.00, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 5

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	0.147	Scopolin	HMDB: HMDB0303366 KEGG: C01527 KNApSAcK: C00002500
C16H18O9	354.09508	0.147	1-(3,4-Dihydroxycinnamoyl)quinic acid	HMDB: HMDB0030652, HMDB0304633 KNApSAcK: C00055231
C16H18O9	354.09508	0.147	Magnolioside	KNApSAcK: C00053451
C16H18O9	354.09508	0.147	trans-4-Caffeoylquinic acid	HMDB: HMDB0030653 KNApSAcK: C00029540, C00053843
C16H18O9	354.09508	0.147	7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone	KNApSAcK: C00055698
C16H18O9	354.09508	0.147	Chlorogenate	HMDB: HMDB0003164, HMDB0029278, HMDB0032849, HMDB0040690, HMDB0240477, HMDB0242450 KEGG: C00852, C17147 KNApSAcK: C00002724, C00030807, C00039428, C00049091, C00052976, C00054083, C00055767
C16H18O9	354.09508	0.147	Isobiflorin	HMDB: HMDB0040632 KNApSAcK: C00030518
C16H18O9	354.09508	0.147	Biflorin	HMDB: HMDB0002336 KEGG: C08996 KNApSAcK: C00002417
C16H18O9	354.09508	0.147	Chrysolandol	KNApSAcK: C00015105

MSnスペクトル情報

Level: 2, プリカーサーm/z: 353.08786

Splash: splash10-0006-0900000000-62fb969559168562f051

m/z	Int.	NL	Rel.Int.
191.04	131788	162	1000

Level: 3, プリカーサーm/z: 190.99838

Splash: splash10-00gi-5900000000-84177835f24eef97d47c

m/z	Int.	NL	Rel.Int.
84.91	4142	106	1000
127.00	3791	64	915
173.03	3415	18	824
93.00	1984	98	479
110.96	1694	80	409
170.91	1251	20	302
109.03	818	82	197
86.88	556	104	134
155.07	496	36	119
70.79	320	120	77
152.97	253	38	61
58.77	210	132	50

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果