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Peak #12142 MN MID: SE205_S02_M90

m/z: 820.56060, RT: 104.11, 強度: 86489, ログ強度: 1.41, アダクト: [M+CH5N+H]+, [M+CH3OH-2(H2O)+NH4]+, 共有数（同様のピークを含むサンプル数）: 8

DB検索結果: (2 names) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-3-O-beta-D-galactosyl-sn-glycerol;1(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(9Z,12Z,15Z)-octadecatrienoyl...

DBごとのヒット数: ALL 2 LM 2

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
C45H72O11	788.50746	4.638	1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-3-O-beta-D-galactosyl-sn-glycerol	LipidMAPS: LMGL05010039
C45H72O11	788.50746	4.638	1(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(9Z,12Z,15Z)-octadecatrienoyl-3-O-beta-D-galactosyl-sn-glycerol	LipidMAPS: LMGL05010046

MSnスペクトル情報

Level: 2, プリカーサーm/z: 820.55658

Splash: splash10-0a4i-0000009000-758a2b391c2483d43887

m/z	Int.	NL	Rel.Int.
609.43	3765	211	1000
627.36	330	193	87

Level: 3, プリカーサーm/z: 609.42908

Splash: splash10-004i-0090000000-301c355fcd44e5ef3c04

m/z	Int.	NL	Rel.Int.
275.31	925	334	1000
293.18	107	316	115
247.34	102	362	110
257.19	91	352	98
239.27	64	370	69

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(1OH, 1OMe, 2(C-Glu))-B(1OH)	Flavone	6,8-Di-C-glucopyranosylgenkwanin
[Flavone]-A(2OH, 1(1(O-(E)-Feruloyl)-C-Glu))-B(1OH)	Flavone	Vitexin 2''-O-(E)-ferulate
[Flavone]-A(2OH, 1(1(O-(E)-Feruloyl)-C-Glu))-B(1OH)	Flavone	Isovitexin 2''-O-(E)-ferulate
[3-substituted Flavone (3-C-Glu)]-A(2OH, 1(C-Glu))-B(1OMe)	3-substituted Flavone	3,6-Di-C-glucopyranosylacacetin
[Flavone]-A(1OH, 1OMe, 1(C-Glu), 1(C-Galactosyl))-B(1OH)	Flavone	6-C-Glucopyranosyl-8-C-galactopyranosylgenkwanin

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	共有数
	104.27	852.58609	32.0255	0.52	[M+2(CH3OH)-2(H2O)+NH4]+	21-Hydroxyoligomycin A	ALL 1 KN 1	MS2	3
	104.11	834.57604	14.0154	0.69	[M+C2H7N+H]+	(2 names) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-3-O-beta-D-galactosyl-sn-glycerol; 1(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(9Z,12Z,15Z)-octadecatrienoyl...	ALL 2 LM 2	MS2	6
12142	104.11	820.56060	0.0000	1.41	[M+CH5N+H]+, [M+CH3OH-2(H2O)+NH4]+	(2 names) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-3-O-beta-D-galactosyl-sn-glycerol; 1(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(9Z,12Z,15Z)-octadecatrienoyl...	ALL 2 LM 2	MS2 MS3	8
	104.05	811.49935	-9.0612	0.91	[M+Na]+, [M-H2O+Na]+	(2 names) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-3-O-beta-D-galactosyl-sn-glycerol; 1(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(9Z,12Z,15Z)-octadecatrienoyl...	ALL 2 LM 2	MS2	10
	104.09	806.54431	-14.0163	0.78	[M+NH4]+, [M-H2O+NH4]+	(2 names) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-3-O-beta-D-galactosyl-sn-glycerol; 1(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(9Z,12Z,15Z)-octadecatrienoyl...	ALL 2 LM 2		10
	104.12	789.51770	-31.0429	1.01	[M+H]+	(2 names) 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-3-O-beta-D-galactosyl-sn-glycerol; 1(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(9Z,12Z,15Z)-octadecatrienoyl...	ALL 2 LM 2		7

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MSnスペクトル情報

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