ピーク情報

リーフレタスグリーン

neg

Peak #8067 MN MID: SE198_S12_M91

m/z: 353.08817, RT: 47.05, 強度: 158432, ログ強度: 1.77, 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: (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	1.026	Scopolin	HMDB: HMDB0303366 KEGG: C01527 KNApSAcK: C00002500
C16H18O9	354.09508	1.026	1-(3,4-Dihydroxycinnamoyl)quinic acid	HMDB: HMDB0030652, HMDB0304633 KNApSAcK: C00055231
C16H18O9	354.09508	1.026	Magnolioside	KNApSAcK: C00053451
C16H18O9	354.09508	1.026	trans-4-Caffeoylquinic acid	HMDB: HMDB0030653 KNApSAcK: C00029540, C00053843
C16H18O9	354.09508	1.026	7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone	KNApSAcK: C00055698
C16H18O9	354.09508	1.026	Chlorogenate	HMDB: HMDB0003164, HMDB0029278, HMDB0032849, HMDB0040690, HMDB0240477, HMDB0242450 KEGG: C00852, C17147 KNApSAcK: C00002724, C00030807, C00039428, C00049091, C00052976, C00054083, C00055767
C16H18O9	354.09508	1.026	Isobiflorin	HMDB: HMDB0040632 KNApSAcK: C00030518
C16H18O9	354.09508	1.026	Biflorin	HMDB: HMDB0002336 KEGG: C08996 KNApSAcK: C00002417
C16H18O9	354.09508	1.026	Chrysolandol	KNApSAcK: C00015105

MSnスペクトル情報

Level: 2, プリカーサーm/z: 353.08792

Splash: splash10-0006-0900000000-ff5a19dde97f0ba631c1

m/z	Int.	NL	Rel.Int.
191.01	57257	162	1000
179.07	22761	174	397
135.03	4341	218	75

Level: 3, プリカーサーm/z: 179.00366

Splash: splash10-000i-0900000000-4fcdee0583342729859e

m/z	Int.	NL	Rel.Int.
135.02	6427	44	1000

Level: 3, プリカーサーm/z: 190.99327

Splash: splash10-00fr-3900000000-e124d4401be9071bd0a2

m/z	Int.	NL	Rel.Int.
173.07	1754	18	1000
126.93	1391	64	792
84.89	1024	106	583
92.96	585	98	333
171.04	477	20	271
110.95	474	80	270
108.87	322	82	183
86.87	217	104	123
155.01	145	36	82
58.93	130	132	73

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