ピーク情報

トマト Micro-Tom 成熟果実の果肉

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Peak #7764 MN MID: SE203_S21_M91

m/z: 353.08823, RT: 53.81, 強度: 25165, ログ強度: 1.03, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 2

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	1.193	Scopolin	HMDB: HMDB0303366 KEGG: C01527 KNApSAcK: C00002500
C16H18O9	354.09508	1.193	1-(3,4-Dihydroxycinnamoyl)quinic acid	HMDB: HMDB0030652, HMDB0304633 KNApSAcK: C00055231
C16H18O9	354.09508	1.193	Magnolioside	KNApSAcK: C00053451
C16H18O9	354.09508	1.193	trans-4-Caffeoylquinic acid	HMDB: HMDB0030653 KNApSAcK: C00029540, C00053843
C16H18O9	354.09508	1.193	7-O-beta-D-glucopyranosyl-8-methoxybenzopyranone	KNApSAcK: C00055698
C16H18O9	354.09508	1.193	Chlorogenate	HMDB: HMDB0003164, HMDB0029278, HMDB0032849, HMDB0040690, HMDB0240477, HMDB0242450 KEGG: C00852, C17147 KNApSAcK: C00002724, C00030807, C00039428, C00049091, C00052976, C00054083, C00055767
C16H18O9	354.09508	1.193	Isobiflorin	HMDB: HMDB0040632 KNApSAcK: C00030518
C16H18O9	354.09508	1.193	Biflorin	HMDB: HMDB0002336 KEGG: C08996 KNApSAcK: C00002417
C16H18O9	354.09508	1.193	Chrysolandol	KNApSAcK: C00015105

MSnスペクトル情報

Level: 2, プリカーサーm/z: 353.08817

Splash: splash10-00fr-0900000000-1cd3d482302fea0f0a9e

m/z	Int.	NL	Rel.Int.
172.99	9885	180	1000
178.97	6641	174	671
191.02	4579	162	463
135.06	855	218	86

Level: 3, プリカーサーm/z: 178.98045

Splash: splash10-001i-0900000000-ac765d8c18128bc64b17

m/z	Int.	NL	Rel.Int.
134.96	1784	44	1000

Level: 3, プリカーサーm/z: 172.95815

Splash: splash10-01ox-9500000000-e4ce57dc4302bdea2caf

m/z	Int.	NL	Rel.Int.
92.89	580	80	1000
110.93	381	62	656
70.88	166	102	286
155.02	89	18	152
58.94	75	114	129
108.95	70	64	120
95.98	49	77	84
56.97	36	116	62
83.11	36	90	62

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