ピーク情報

トマト Micro-Tom 花

pos

Peak #2545 MN MID: SE203_S31_M90

m/z: 501.27036, RT: 30.62, 強度: 343187, ログ強度: 1.88, アダクト: [2M+H]+, 共有数（同様のピークを含むサンプル数）: 4

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	-0.812	(2-Phenylacetyl) (2R)-2,5-diaminopentanoate	HMDB: HMDB0242478
C13H18O3N2	250.13174	-0.812	N-Caffeoylputrescine	HMDB: HMDB0029876 KEGG: C03002 KNApSAcK: C00002719
C13H18O3N2	250.13174	-0.812	3-Hydroxymelatonin	HMDB: HMDB0060742
C13H18O3N2	250.13174	-0.812	1-Coumaroyl-2-hydroxyputrescine	HMDB: HMDB0033462 KNApSAcK: C00054893
C13H18O3N2	250.13174	-0.812	Heptabarbital	HMDB: HMDB0015443 KEGG: C17725
C13H18O3N2	250.13174	-0.812	Jenamidine A	KNApSAcK: C00014973
C13H18O3N2	250.13174	-0.812	Lacosamide	HMDB: HMDB0253940

MSnスペクトル情報

Level: 2, プリカーサーm/z: 501.26944

Splash: splash10-0udi-0090000000-2f1a5613e53248df5775

m/z	Int.	NL	Rel.Int.
251.14	30171	250	1000
234.09	2856	267	94

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: 251.13791

Splash: splash10-001i-1290000000-e80330a88c213781b78b

m/z	Int.	NL	Rel.Int.
234.09	10251	17	1000
88.92	1604	162	156
192.03	809	59	78
163.02	774	88	75
114.01	741	137	72

Level: 3, プリカーサーm/z: 234.09033

Splash: splash10-03di-0900000000-eff88e748ed52960d43b

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