ピーク情報

トマト Micro-Tom 花

pos

Peak #2102 MN MID: SE203_S31_M90

m/z: 501.27017, RT: 28.75, 強度: 22910, ログ強度: 0.70, アダクト: [2M+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (7 names) Paucine;(2-Phenylacetyl) (2R)-2,5-diaminopentanoate;1-Coumaroyl-2-hydroxyputrescine;3-Hydroxymelatonin;Heptabarbital;Jenamidine A;Lacosamide

DBごとのヒット数: ALL 7 KG 2 KN 2 HM 3

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
C13H18O3N2	250.13174	-1.178	(2-Phenylacetyl) (2R)-2,5-diaminopentanoate	HMDB: HMDB0242478
C13H18O3N2	250.13174	-1.178	N-Caffeoylputrescine	HMDB: HMDB0029876 KEGG: C03002 KNApSAcK: C00002719
C13H18O3N2	250.13174	-1.178	3-Hydroxymelatonin	HMDB: HMDB0060742
C13H18O3N2	250.13174	-1.178	1-Coumaroyl-2-hydroxyputrescine	HMDB: HMDB0033462 KNApSAcK: C00054893
C13H18O3N2	250.13174	-1.178	Heptabarbital	HMDB: HMDB0015443 KEGG: C17725
C13H18O3N2	250.13174	-1.178	Jenamidine A	KNApSAcK: C00014973
C13H18O3N2	250.13174	-1.178	Lacosamide	HMDB: HMDB0253940

MSnスペクトル情報

Level: 2, プリカーサーm/z: 501.27011

Splash: splash10-0udi-0090000000-70fb61ef61aaf37410d6

m/z	Int.	NL	Rel.Int.
251.13	4638	250	1000
234.10	381	267	82

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavan 3-ol]-A(1OH, 1OMe)-B(1OH, 2OMe)-C(1(O-Galloyl))	Flavan 3-ol	Gallocatechin 5,3',5'-trimethyl ether 3-O-gallate
[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artonol C
[Dihydroflavonol]-A(2OH, 2(p-Hydroxybenzyl) )-B(1OH)	Dihydroflavonol	Gericudranin D

Level: 3, プリカーサーm/z: 251.13008

Splash: splash10-001i-1190000000-aa80778aaf7352911b52

m/z	Int.	NL	Rel.Int.
234.10	1571	17	1000
88.97	221	162	140
163.06	101	88	64
192.16	100	59	63
114.01	79	137	50

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果