ピーク情報

リーフレタスグリーン

neg

Peak #3964 MN MID: SE198_S12_M91

m/z: 353.08812, RT: 36.94, 強度: 1999740, ログ強度: 2.87, 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	0.895	Scopolin	HMDB: HMDB0303366 KEGG: C01527 KNApSAcK: C00002500
C16H18O9	354.09508	0.895	1-(3,4-Dihydroxycinnamoyl)quinic acid	HMDB: HMDB0030652, HMDB0304633 KNApSAcK: C00055231
C16H18O9	354.09508	0.895	Magnolioside	KNApSAcK: C00053451
C16H18O9	354.09508	0.895	trans-4-Caffeoylquinic acid	HMDB: HMDB0030653 KNApSAcK: C00029540, C00053843
C16H18O9	354.09508	0.895	7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone	KNApSAcK: C00055698
C16H18O9	354.09508	0.895	Chlorogenate	HMDB: HMDB0003164, HMDB0029278, HMDB0032849, HMDB0040690, HMDB0240477, HMDB0242450 KEGG: C00852, C17147 KNApSAcK: C00002724, C00030807, C00039428, C00049091, C00052976, C00054083, C00055767
C16H18O9	354.09508	0.895	Isobiflorin	HMDB: HMDB0040632 KNApSAcK: C00030518
C16H18O9	354.09508	0.895	Biflorin	HMDB: HMDB0002336 KEGG: C08996 KNApSAcK: C00002417
C16H18O9	354.09508	0.895	Chrysolandol	KNApSAcK: C00015105

MSnスペクトル情報

Level: 2, プリカーサーm/z: 353.08740

Splash: splash10-0006-0900000000-1572bec785475612be8a

m/z	Int.	NL	Rel.Int.
191.01	888789	162	1000

Level: 3, プリカーサーm/z: 190.95743

Splash: splash10-00gi-4900000000-4c0fa004c972e0575ba8

m/z	Int.	NL	Rel.Int.
172.96	11155	18	1000
126.97	11035	64	989
84.92	9424	106	844
92.88	6095	98	546
110.99	4122	80	369
171.08	3698	20	331
108.91	2337	82	209
86.90	1419	104	127
70.92	792	120	70
154.97	717	36	64
152.99	711	38	63

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果