ピーク情報

＜魚類＞（さけ・ます類）からふとます生

pos

Peak #1984 MN MID: SE123_S101261_M90

m/z: 456.40474, RT: 91.64, 強度: 50452, ログ強度: 0.97, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 14

DB検索結果: (17 names) 10-methylnonadecanoylcarnitine;9-methylnonadecanoylcarnitine;15-methylnonadecanoylcarnitine;18-methylnonadecanoylcarnitine;12-methylnonadecanoylcarnitine;8-methylnonadecanoylcarnitine;7-methylnonadeca...

DBごとのヒット数: ALL 17 HM 16 LM 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.214

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
C27H53O4N	455.39746	0.005	10-methylnonadecanoylcarnitine	HMDB: HMDB0240898
C27H53O4N	455.39746	0.005	9-methylnonadecanoylcarnitine	HMDB: HMDB0240897
C27H53O4N	455.39746	0.005	15-methylnonadecanoylcarnitine	HMDB: HMDB0240908
C27H53O4N	455.39746	0.005	18-methylnonadecanoylcarnitine	HMDB: HMDB0240909
C27H53O4N	455.39746	0.005	12-methylnonadecanoylcarnitine	HMDB: HMDB0240900
C27H53O4N	455.39746	0.005	8-methylnonadecanoylcarnitine	HMDB: HMDB0240904
C27H53O4N	455.39746	0.005	7-methylnonadecanoylcarnitine	HMDB: HMDB0240901
C27H53O4N	455.39746	0.005	11-methylnonadecanoylcarnitine	HMDB: HMDB0240907
C27H53O4N	455.39746	0.005	17-methylnonadecanoylcarnitine	HMDB: HMDB0240910
C27H53O4N	455.39746	0.005	13-methylnonadecanoylcarnitine	HMDB: HMDB0240903
C27H53O4N	455.39746	0.005	14-methylnonadecanoylcarnitine	HMDB: HMDB0240899
C27H53O4N	455.39746	0.005	4-methylnonadecanoylcarnitine	HMDB: HMDB0240912
C27H53O4N	455.39746	0.005	3-methylnonadecanoylcarnitine	HMDB: HMDB0240911
C27H53O4N	455.39746	0.005	6-methylnonadecanoylcarnitine	HMDB: HMDB0240902
C27H53O4N	455.39746	0.005	Arachidyl carnitine	HMDB: HMDB0006460 LipidMAPS: LMFA07070052
C27H53O4N	455.39746	0.005	16-methylnonadecanoylcarnitine	HMDB: HMDB0240905
C27H53O4N	455.39746	0.005	5-methylnonadecanoylcarnitine	HMDB: HMDB0240906

MSnスペクトル情報

Level: 2, プリカーサーm/z: 456.40411

Splash: splash10-0002-0019000000-83af52f64d60962923bf

m/z	Int.	NL	Rel.Int.
397.36	4501	59	1000
295.24	862	161	191
313.39	239	143	53

Level: 3, プリカーサーm/z: 397.36411

Splash: splash10-0002-0290000000-0bae20816e09de48c448

m/z	Int.	NL	Rel.Int.
295.23	556	102	1000
123.01	91	274	163
276.83	83	121	149
125.01	39	272	70
164.90	31	232	56
313.54	31	84	56

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.214	[Flavanone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	Flavanone	Ponganone IV
0.214	[Flavanone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	Flavanone	Glyflavanone B
0.143	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(3OMe)	2'-Hydroxychalcone	Glabrachalcone
0.143	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	2'-Hydroxychalcone	Ponganone VI
0.143	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	2'-Hydroxychalcone	Glychalcone B
0.143	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	2'-Hydroxychalcone	6'',6''-Dimethylpyrano[2'',3'':6',5']-2'-hydroxy-3,4,4'-trimethoxychalcone
0.083	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 2OMe)	Isoflavone	Elongatin
0.080	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 2OMe)	Isoflavone	Pumilaisoflavone D
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 2OMe)	Flavone	5-Hydroxy-8-(4-hydroxy-3,5-dimethoxyphenyl)-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy))	2'-Hydroxychalcone	Ovalichalcone A
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(2OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy))	beta-Hydroxy(or Oxodihydro)chalcone	Pongagallone B
0.000	[Flavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH, 2Methyl)	Flavone	Muxiangrin III
0.000	[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1OMe)-B(2OH, 1OMe)	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artoindonesianin S
0.000	[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1OMe)-B(1OH, 1OMe)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Artonin L
0.000	[Flavonol (3-OMe)]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 1OMe)	Flavonol	Velloquercetin 3,3'-dimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1Methyl, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OH)	Flavonol	8-C-Methylvelloquercetin 3-methyl ether
0.000	[Flavonol (3-OMe)]-A(2OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Flavonol	3,5,6-Trimethoxy-3',4'-methylene-dioxyfurano[2,3:7,8]flavone
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 2OMe)	Isoflavone	5,4'-Dihydroxy-3',5'-dimethoxy-(5''-Isopropenyldihydrofurano)[2'',3'':7,6]isoflavone
0.000	[Pterocarpan]-A(2OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy))	Pterocarpan	Neoraucarpan
0.000	[Rotenone]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(1OH, 1OMe)	Rotenone	3-O-Demethylamorphigenin
0.000	[Rotenone]-A(1OH, 1(C-Prenyl))-B(2OMe)	Rotenone	Rotenonic acid
0.000	[4-Benzoylchroman]-A(2OMe)-B(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))	4-Benzoylchroman	Rotenol

Level: 3, プリカーサーm/z: 295.24438

Splash: splash10-06y9-1920000000-60de7936bcbe2b428aad

m/z	Int.	NL	Rel.Int.
123.09	17	172	1000
110.89	13	184	731
235.43	12	60	667
107.17	10	188	556
97.14	8	198	479
137.11	6	158	369
151.15	5	144	306

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Auronol (2-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Auronol	Castillene A
[beta-Hydroxy(or Oxodihydro)chalcone]-A(1OMe, 1Oxo, 1([2,3:@@]-Furano))-B(none)	beta-Hydroxy(or Oxodihydro)chalcone	Pongamol
[Flavanone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavanone	6-Methoxy-[2'',3'':7,8]furanoflavanone
[Dihydroflavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Dihydroflavonol	3-Methoxy-[2'',3'':7,8]furanoflavanone
[2-substituted Isoflavone (2-Methyl)]-A(1OH, 1Acetyl)-B(none)	2-substituted Isoflavone	Glyzarin
[Pterocarpan]-A(1([2,3:@@]-Furano))-B(1OMe)	Pterocarpan	9-O-Methylneodunol