ピーク情報

シロイヌナズナ　地上部

pos

Peak #12511 MN MID: SE200_S1_M90

m/z: 873.47820, RT: 98.74, 強度: 136702, ログ強度: 1.60, アダクト: [M+IsoProp-H2O+K]+, [M+3(CH3OH)+Na]+, [M+K]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (2 names) Stichoposide;Sanguisorbin E

DBごとのヒット数: ALL 2 HM 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
C43H68O13	792.46599	2.649	Stichoposide	HMDB: HMDB0258497
C43H68O13	792.46599	2.649	Sanguisorbin E	HMDB: HMDB0040523

MSnスペクトル情報

Level: 2, プリカーサーm/z: 873.47754

Splash: splash10-001j-0000090000-d9e1a9fb88a62c2e2cd7

m/z	Int.	NL	Rel.Int.
581.31	2137	292	1000
549.31	1685	324	788
550.41	555	323	259
582.36	484	291	226

Level: 3, プリカーサーm/z: 581.34259

Splash: splash10-0002-0000900000-9138595c4c43721f4d4c

m/z	Int.	NL	Rel.Int.
497.12	31	84	1000

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(2OH)	Flavone	Lucenin 1
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(2OH)	Flavone	Lucenin 3
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Carlinoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Isocarlinoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Neocarlinoside

Level: 3, プリカーサーm/z: 549.31909

Splash: splash10-0019-0009050000-061710f1fb86a929fbc2

m/z	Int.	NL	Rel.Int.
388.29	12	161	1000
531.46	8	18	619

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl))-B(2OH)	2'-Hydroxychalcone	3,4-Dihydroxyrottlerin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(none)	Flavone	Chrysin 6-C-glucoside-8-C-alpha-L-arabinopyranoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(none)	Flavone	Chrysin 6-C-alpha-L-arabinopyranoside-8-C-glucoside
[Flavone]-A(1OH, 1OMe, 2(C-Arabinosyl))-B(1OH)	Flavone	Almeidein
[4-substituted Flavan (4-(1-dodecanoyl-2,4,6-trihydroxyphenyl))]-A(1OH)-B(1OH)	4-substituted Flavan	Myristinin A

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
	99.21	905.50544	32.0272	2.16	[M+CH3OH+IsoProp-H2O+K]+, [M+DMSO+Na]+, [M+K]+	(3 names) Stichoposide; Sanguisorbin E; PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ALL 3 HM 2 LM 1	MS2	1
12511	98.74	873.47820	0.0000	1.60	[M+IsoProp-H2O+K]+, [M+3(CH3OH)+Na]+, [M+K]+	(2 names) Stichoposide; Sanguisorbin E	ALL 2 HM 2	MS2 MS3 x 2	1
	98.75	852.55076	-20.9274	2.12	[M+C2H7N+CH3OH-H2O+H]+, [M+C2H7N+CH3OH+IsoProp+Na]+, [M+2(CH3OH)+CH5N+IsoProp-H2O+Na]+, [M+3(CH3OH)-4(H2O)+NH4]+, [M+IsoProp-2(H2O)+NH4]+, [M+NH4]+	(3 names) PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)); Stichoposide; Sanguisorbin E	ALL 3 HM 2 LM 1		2

ピーク情報

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MSnスペクトル情報

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