ピーク情報

＜魚類＞ほうぼう生

pos

Peak #1020 MN MID: SE169_S102441_M90

m/z: 1045.15004, RT: 12.89, 強度: 532269, ログ強度: 2.18, アダクト: [3M+H]+, 共有数（同様のピークを含むサンプル数）: 31

DB検索結果: (11 names) Inosine 2'-phosphate;Inosinic acid;Pinnatazone;3-Deoxy-D-glycero-D-galacto-non-2-ulopyranosonate 9-phosphate;2-Keto-3-deoxy-D-glycero-D-galacto-nononate 9-phosphate;3-Deoxy-D-glycero-D-galacto-non-2-u...

DBごとのヒット数: ALL 8 KG 4 KN 1 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
C10H13O8N4P	348.04710	1.398	Inosine 2'-phosphate	HMDB: HMDB0011681
C10H13O8N4P	348.04710	1.398	IMP	HMDB: HMDB0000175, HMDB0257686 KEGG: C00130 KNApSAcK: C00007224
C15H22O2BrCl	348.04917	-4.542	Pinnatazone	KNApSAcK: C00021638, C00021639

MSnスペクトル情報

Level: 2, プリカーサーm/z: 1045.14832

Splash: splash10-0002-0000009000-bc9f46e211bb54cea31c

m/z	Int.	NL	Rel.Int.
696.99	19146	348	1000
348.96	1379	696	72

Level: 3, プリカーサーm/z: 696.99408

Splash: splash10-0002-0009110000-66519b46248e555df7a3

m/z	Int.	NL	Rel.Int.
348.97	8381	348	1000
484.76	982	212	117
560.94	966	136	115

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Dihydrochalcone]-A(2OH, 1OMe, 1(2-Hydroxybenzyl), 1(3x2-hydroxybenzyl))-B(none)	Dihydrochalcone	2',4'-Dihydroxy-6'-methoxy-3'-(2-hydroxybenzyl)-5'-(3 x 2-hydroxybenzyl)dihydrochalcone

Level: 3, プリカーサーm/z: 348.95639

Splash: splash10-000i-0910000000-4db29c7c90e4a55e19ca

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Coumestan]-A(1OMe)-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Coumestan	Tuberostan
[Dihydroflavonol]-A(2OH)-B(1OH, 2OMe)	Dihydroflavonol	Dihydrosyringetin
[Dihydroflavonol]-A(2OH, 1OMe)-B(1OH, 1OMe)	Dihydroflavonol	3,5,7,3'-Tetrahydroxy-8,4'-dimethoxyflavanone
[Dihydroflavonol]-A(1OH, 2OMe)-B(2OH)	Dihydroflavonol	Dihydrogossypetin 7,8-dimethyl ether
[Isoflavan]-A(2OH, 1OMe)-B(1OH, 2OMe)	Isoflavan	Machaerol C
[Flavonol]-A(3OH)-B(2OH, 1OMe)	Flavonol	3,6,7,8,3',4'-Hexahydroxy-5'-methoxyflavone
[Flavonol]-A(2OH, 1OMe)-B(3OH)	Flavonol	Hibiscetin 8-methyl ether
[Flavonol]-A(4OH)-B(1OH, 1OMe)	Flavonol	3,5,6,7,8,4'-Hexahydroxy-3'-methoxyflavone
[Flavan 3-ol]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavan 3-ol	Gallocatechin 7,3',5'-trimethyl ether
[Flavone]-A(1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavone	6'',6''-Dimethyl-3',4'-methylenedioxypyrano[2'',3'':7,8]flavone
[Flavone]-A(2OMe, 1(3-Methylbutadienyl))-B(none)	Flavone	trans-Anhydrotephrostachin
[Dihydroflavonol]-A(2OH, 2Methyl)-B(3OH)	Dihydroflavonol	3,5,7,3',4',5'-Hexahydroxy-6,8-dimethylflavanone
[4-substituted Flavan 3-ol (4-Carboxymethyl)]-A(2OH)-B(2OH)	4-substituted Flavan 3-ol	Dryopteric acid
[Isoflavone]-A(1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Calopogoniumisoflavone B
[Pterocarpan]-A(1([2,3:@@]-Furano))-B(1OH, 1(C-Prenyl))	Pterocarpan	Erybraedin E

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

m/z	Int.	NL	Rel.Int.
136.99	1316	212	1000
233.01	214	116	162
118.85	138	230	104