ピーク情報

トマト Micro-Tom 成熟果実の果皮

neg

Peak #6165 MN MID: SE203_S11_M91

m/z: 515.11987, RT: 45.72, 強度: 155659, ログ強度: 1.75, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (13 names) 2'',6''-Di-O-Acetyl isovitexin;2'',4''-Diacetylafzelin;Formononetin 7-(6''-malonylglucoside);Isochlorogenic acid b;1,3-Dicaffeoylquinic acid;3'',4''-Diacetylcosmosiin;3'',4''-Diacetylafzelin;Daidzein ...

DBごとのヒット数: ALL 12 KG 3 KN 9

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
C25H24O12	516.12678	0.723	2'',6''-Di-O-Acetyl isovitexin	FlavonoidViewer: FL3FAACS0080 KNApSAcK: C00014079 LipidMAPS: LMPK12110270
C25H24O12	516.12678	0.723	Kaempferol 3-(2'',4''-diacetylrhamnoside)	FlavonoidViewer: FL5FAAGS0052 HMDB: HMDB0040138 KNApSAcK: C00005865 LipidMAPS: LMPK12111888
C25H24O12	516.12678	0.723	Formononetin 7-O-(6-O-malonyl-beta-D-glucoside)	FlavonoidViewer: FLIA1AGS0008 HMDB: HMDB0029493 KEGG: C16222 KNApSAcK: C00010083 LipidMAPS: LMPK12050020
C25H24O12	516.12678	0.723	Isochlorogenic acid b	HMDB: HMDB0030705, HMDB0030707, HMDB0253617, HMDB0304637 KEGG: C10468 KNApSAcK: C00002751, C00029480, C00029520, C00034768
C25H24O12	516.12678	0.723	1,3-Dicaffeoylquinic acid	HMDB: HMDB0029279, HMDB0030093, HMDB0242355 KEGG: C10445 KNApSAcK: C00002733, C00044046
C25H24O12	516.12678	0.723	Apigenin 7-(3'',4''-diacetylglucoside)	FlavonoidViewer: FL3FAAGS0049 HMDB: HMDB0037344 KNApSAcK: C00004189 LipidMAPS: LMPK12110383
C25H24O12	516.12678	0.723	Kaempferol 3-(3'',4''-diacetylrhamnoside)	FlavonoidViewer: FL5FAAGS0053 HMDB: HMDB0040139 KNApSAcK: C00005866 LipidMAPS: LMPK12111889
C25H24O12	516.12678	0.723	Daidzein 7-O-(6''-succinylglucoside)	KNApSAcK: C00019756
C25H24O12	516.12678	0.723	Apigenin 7-(2'',3''-diacetylglucoside)	FlavonoidViewer: FL3FAAGS0048 HMDB: HMDB0037343 KNApSAcK: C00004188 LipidMAPS: LMPK12110382
C25H24O12	516.12678	0.723	(+)-Vitisin B	HMDB: [1]HMDB0036825 KNApSAcK: [1]C00052491
C25H24O12	516.12678	0.723	1,4-Bis-(3,4-dihydroxycinnamoyl)quinic acid	HMDB: HMDB0034766, HMDB0250259 KNApSAcK: C00055091
C25H24O12	516.12678	0.723	3,5-Dicaffeoylquinate	HMDB: HMDB0029280 KEGG: C22991 KNApSAcK: C00029481, C00033559

MSnスペクトル情報

Level: 2, プリカーサーm/z: 515.11938

Splash: splash10-0udi-0109000000-7612322eb9c3c51dd73e

m/z	Int.	NL	Rel.Int.
353.13	153346	162	1000
335.21	22264	180	145
173.00	19901	342	129
179.09	10855	336	70
202.97	8363	312	54

Level: 3, プリカーサーm/z: 353.13995

Splash: splash10-00fu-0900000000-37c12b8e1493b4df2b96

m/z	Int.	NL	Rel.Int.
172.99	18159	180	1000
178.96	11727	174	645
191.04	9341	162	514
134.99	1287	218	70

Level: 3, プリカーサーm/z: 335.21332

Splash: splash10-01t9-0980000000-daabb92e18ef62899777

m/z	Int.	NL	Rel.Int.
179.08	1070	156	1000
160.95	690	174	644
211.14	648	124	605
229.02	375	106	350
254.96	369	80	344
173.10	335	162	313
203.12	270	132	252
291.35	214	44	200
273.07	212	62	198
135.05	157	200	147
299.08	137	36	128
237.23	123	98	114
158.99	117	176	108
155.00	81	180	75
317.11	79	18	73
263.37	60	72	56

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MSnスペクトル情報

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