ピーク情報

＜魚類＞きんめだい生

pos

Peak #236 MN MID: SE118_S101161_M90

m/z: 503.23434, RT: 10.66, 強度: 151981, ログ強度: 1.60, アダクト: [2M+Na]+, 共有数（同様のピークを含むサンプル数）: 12

DB検索結果: (7 names) Anserine;N(alpha)-gamma-L-Glutamylhistamine;Nalpha-gamma-L-glutamylhistamine;Balenine;alpha-((2,3-Dimethyl-1-aziridinyl)methyl)-2-nitro-1H-imidazole-1-ethanol;Homocarnosine;Triglycerol

DBごとのヒット数: ALL 6 KG 3 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
C10H16O3N4	240.12224	1.318	Anserine	HMDB: HMDB0000194 KEGG: C01262 KNApSAcK: C00052191
C10H16O3N4	240.12224	1.318	Balenine	HMDB: HMDB0005769
C10H16O3N4	240.12224	1.318	N(alpha)-gamma-L-Glutamylhistamine	KEGG: C04138
C10H16O3N4	240.12224	1.318	alpha-((2,3-Dimethyl-1-aziridinyl)methyl)-2-nitro-1H-imidazole-1-ethanol	HMDB: HMDB0243785
C10H16O3N4	240.12224	1.318	Homocarnosine	HMDB: HMDB0000745 KEGG: C00884

MSnスペクトル情報

Level: 2, プリカーサーm/z: 503.23376

Splash: splash10-03di-0090000000-6c8feb8a362b4b43f03d

m/z	Int.	NL	Rel.Int.
263.12	11003	240	1000

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Coumaroyl)-(E)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Demethoxyisogemichalcone C
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Cycloheterophyllin
[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(2OH, 1(C-Prenyl))-B(2OH, 1(1([2,3:@@]-(6,6-Dimethylpyrano))))	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artonin N
[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Artonin F
[CCS-type derivative / [2,2a,5:3',2',3]-7-Methyl-7-(4-Methyl-3-pentenyl)tetrahydroisobenzofuranoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	CCS-type derivative / [2,2a,5:3',2',3]-7-Methyl-7-(4-Methyl-3-pentenyl)tetrahydroisobenzofuranoflavone	Artonin M
[UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethanoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethanoflavone	Artonin O
[Coumaranochromon]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Coumaranochromon	Euchretin A

Level: 3, プリカーサーm/z: 263.16495

Splash: splash10-0005-0790000000-52e71dd8351b585ac6b6

m/z	Int.	NL	Rel.Int.
246.10	232	17	1000
191.15	125	72	536
219.12	60	44	259
192.11	60	71	257
167.08	29	96	126
245.16	26	18	110
145.96	20	117	85
234.14	17	29	72
168.01	16	95	68
112.04	13	151	55

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Aurone]-A(1([2,3:@@]-Furano))-B(none)	Aurone	Furano[2'',3'':6,7]aurone

関連ピーク情報

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	FS2	FS3	共有数
236	10.66	503.23434	0.0000	1.60	[2M+Na]+	(7 names) Anserine; N(alpha)-gamma-L-Glutamylhistamine; Nalpha-gamma-L-glutamylhistamine; Balenine; alpha-((2,3-Dimethyl-1-aziridinyl)methyl)-2-nitro-1H-imidazole-1-ethanol; Homocarnosine; Triglycerol	ALL 6 KG 3 HM 3	MS2 MS3			12
	10.34	481.25218	-21.9822	2.63	[2M+H]+	(7 names) Anserine; N(alpha)-gamma-L-Glutamylhistamine; Nalpha-gamma-L-glutamylhistamine; Balenine; alpha-((2,3-Dimethyl-1-aziridinyl)methyl)-2-nitro-1H-imidazole-1-ethanol; Homocarnosine; Triglycerol	ALL 6 KG 3 HM 3	MS2 MS3 x 2			16

ピーク情報

DB検索結果

MSnスペクトル情報

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