ピーク情報

トマト Micro-Tom 成熟果実の果肉

pos

Peak #8187 MN MID: SE203_S21_M90

m/z: 225.14852, RT: 71.88, 強度: 2082, ログ強度: -0.16, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (20 names) Vomifoliol;Methyl 10R-hydroxydodec-8E-en-11-ynoate;Sundiversifolide;4,15-Dinor-3-hydroxy-1(5)-xanthene-12,8-olide;MKN-003A;(+)-MKN-003A;3-Methylbutyl 2-furanbutanoate;Jhanilactone;Annuionone C;13-Oxo-...

DBごとのヒット数: ALL 18 KG 2 KN 8 HM 4 LM 4

FlavonoidSearch最大スコア MS2: 0.111, MS3: -

DB検索結果

ppm

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
C13H20O3	224.14124	-0.000	(6S,9R)-Vomifoliol	HMDB: HMDB0303570 KEGG: C01760, C04166 KNApSAcK: C00029834
C13H20O3	224.14124	-0.000	Methyl 10R-hydroxydodec-8E-en-11-ynoate	LipidMAPS: LMFA01050594
C13H20O3	224.14124	-0.000	Sundiversifolide	HMDB: HMDB0037244 KNApSAcK: C00037865
C13H20O3	224.14124	-0.000	MKN-003A	KNApSAcK: C00046159
C13H20O3	224.14124	-0.000	3-Methylbutyl 2-furanbutanoate	HMDB: HMDB0037736
C13H20O3	224.14124	-0.000	Jhanilactone	KNApSAcK: C00021928
C13H20O3	224.14124	-0.000	Annuionone C	HMDB: HMDB0032689 KNApSAcK: C00044091
C13H20O3	224.14124	-0.000	13-Oxo-9,11-tridecadienoic acid	HMDB: HMDB0034564 LipidMAPS: LMFA01060202
C13H20O3	224.14124	-0.000	Grasshopper ketone	HMDB: HMDB0303443 KNApSAcK: C00031831
C13H20O3	224.14124	-0.000	3-Methyl-5-pentyl-2-furanpropanoic acid	HMDB: HMDB0112084
C13H20O3	224.14124	-0.000	11-hydroxy-4-methyl-2E,4E,6E-dodecatrienoic acid	LipidMAPS: LMFA01020413
C13H20O3	224.14124	-0.000	Epoxyeremopetasinorol	HMDB: HMDB0029670
C13H20O3	224.14124	-0.000	Furfuryl octanoate	HMDB: HMDB0037730 LipidMAPS: LMFA07010891
C13H20O3	224.14124	-0.000	Annuionone A	HMDB: HMDB0032679 KNApSAcK: C00035806
C13H20O3	224.14124	-0.000	Apiosporic acid	KNApSAcK: C00044528
C13H20O3	224.14124	-0.000	Methyl jasmonate	HMDB: HMDB0036583, HMDB0253727, HMDB0301800 KEGG: C11512, C16318 KNApSAcK: C00000219, C00000223 LipidMAPS: LMFA02020010, LMFA02020016
C13H20O3	224.14124	-0.000	Octyl 2-furoate	HMDB: HMDB0037726
C13H20O3	224.14124	-0.000	3-Oxo-2-(2Z-Pentenyl)cyclopentyl propionic acid	KNApSAcK: C00000229

MSnスペクトル情報

Level: 2, プリカーサーm/z: 225.14822

Splash: splash10-0a4i-0090000000-8a068d61742a97c0b229

m/z	Int.	NL	Rel.Int.
207.06	2206	18	1000
183.97	155	41	70

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.111	[Chalcone]-A(1OH)-B(none)	Chalcone	4'-Hydroxychalcone

Level: 3, プリカーサーm/z: 207.06122

Splash: splash10-00ds-0900000000-42e5211f1ad308be116a

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

m/z	Int.	NL	Rel.Int.
171.05	270	36	1000
189.14	252	18	932
147.08	168	60	622
160.98	126	46	467
179.02	94	28	348
129.01	27	78	100
145.13	27	62	100
109.01	19	98	71
174.87	19	32	71
165.12	18	42	68
93.01	16	114	58