ピーク情報

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Peak #9440 MN MID: SE205_S02_M90

m/z: 521.31157, RT: 84.35, 強度: 1162500, ログ強度: 2.54, アダクト: [M-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (4 names) Sanjoinine G2;Integristerone A 25-acetate;22beta-acetoxy-2beta,3beta,11alpha,14alpha,20,25-hexahydroxy-5beta-cholest-7-en-6-one;25-acetoxy-2beta,3beta,11alpha,14alpha,20R,22R-hexahydroxy-5beta-cholest...

DBごとのヒット数: ALL 4 KN 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
C30H42O5N4	538.31552	-1.226	Sanjoinine G2	KNApSAcK: C00028962
C29H46O9	538.31418	1.258	Integristerone A 25-acetate	KNApSAcK: C00045323 LipidMAPS: LMST01010587
C29H46O9	538.31418	1.258	22beta-acetoxy-2beta,3beta,11alpha,14alpha,20,25-hexahydroxy-5beta-cholest-7-en-6-one	LipidMAPS: LMST01010424
C29H46O9	538.31418	1.258	25-acetoxy-2beta,3beta,11alpha,14alpha,20R,22R-hexahydroxy-5beta-cholest-7-en-6-one	LipidMAPS: LMST01010428

MSnスペクトル情報

Level: 2, プリカーサーm/z: 521.31055

Splash: splash10-0udi-0560970000-ee82e0964b1d29b2572f

m/z	Int.	NL	Rel.Int.
404.97	1271	116	1000
293.11	1038	228	816
503.39	827	18	650
176.95	808	344	635
521.13	255	0	201
493.23	69	28	54

Level: 3, プリカーサーm/z: 293.15594

Splash: splash10-004i-0900000000-1510df9c8e68de185fbf

m/z	Int.	NL	Rel.Int.
177.04	1274	116	1000
145.01	98	148	76

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Aurone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Aurone	4-Methoxyfurano[2'',3'':6,7]aurone
[2-(alpha-oxobenzyl)benzofuran (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	2-(alpha-oxobenzyl)benzofuran	Derriobtusone A
[alpha-substituted Chalcone (alpha-Methyl)]-A(1OMe, 1Methyl, 1([2,3:@@]-Furano))-B(none)	alpha-substituted Chalcone	Purpuritenin B
[Chalcone]-A(1OMe, 1([2,3:@@]-Furano))-B(1Methyl)	Chalcone	Purpuritenin A
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	2-(2-Methoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	Pongone
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	Cauliflorin A
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	Glabone
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	2-(4-Methoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one
[Flavone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavone	Kanjone
[Flavone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavone	9-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one
[Flavone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavone	Pinnatin
[Flavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Flavonol	Karanjin
[Flavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Flavonol	Ponganone XI

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	FS3	共有数
	84.37	570.36498	49.0534	0.91	[M+CH5N+H]+	(4 names) Sanjoinine G2; Integristerone A 25-acetate; 22beta-acetoxy-2beta,3beta,11alpha,14alpha,20,25-hexahydroxy-5beta-cholest-7-en-6-one; 25-acetoxy-2beta,3beta,11alpha,14alpha,20R,22R-hexahydroxy-5beta-cholest...	ALL 4 KN 2 LM 2			1
	84.39	561.30448	39.9929	1.12	[M+Na]+	(4 names) Sanjoinine G2; Integristerone A 25-acetate; 22beta-acetoxy-2beta,3beta,11alpha,14alpha,20,25-hexahydroxy-5beta-cholest-7-en-6-one; 25-acetoxy-2beta,3beta,11alpha,14alpha,20R,22R-hexahydroxy-5beta-cholest...	ALL 4 KN 2 LM 2			1
	84.56	556.34929	35.0377	1.16	[M+C2H7N+H]+, [M+ACN+H]+, [M+NH4]+	(4 names) 16-Diacetoxy-7alpha-hydroxy-18-malonyloxy-ent-cleroda-3-ene; methyl 9S,hydroxy-11R,15S,18-triacetoxy-5Z,13E-prostadienoate; 1-(3Z,6Z,9Z,12Z,15Z-octadecapentaenoyl)-3-O-beta-D-galactosyl-sn-glycerol; meth...	ALL 4 KN 1 LM 3	MS2		1
	84.64	539.32209	18.0105	1.82	[M+H]+	(4 names) Integristerone A 25-acetate; 22beta-acetoxy-2beta,3beta,11alpha,14alpha,20,25-hexahydroxy-5beta-cholest-7-en-6-one; 25-acetoxy-2beta,3beta,11alpha,14alpha,20R,22R-hexahydroxy-5beta-cholest-7-en-6-one; Sa...	ALL 4 KN 2 LM 2	MS2 MS3 x 2	0.250	1
9440	84.35	521.31157	0.0000	2.54	[M-H2O+H]+	(4 names) Sanjoinine G2; Integristerone A 25-acetate; 22beta-acetoxy-2beta,3beta,11alpha,14alpha,20,25-hexahydroxy-5beta-cholest-7-en-6-one; 25-acetoxy-2beta,3beta,11alpha,14alpha,20R,22R-hexahydroxy-5beta-cholest...	ALL 4 KN 2 LM 2	MS2 MS3		1
	84.32	503.30095	-18.0106	1.04	[M-2(H2O)+H]+	(4 names) Integristerone A 25-acetate; 22beta-acetoxy-2beta,3beta,11alpha,14alpha,20,25-hexahydroxy-5beta-cholest-7-en-6-one; 25-acetoxy-2beta,3beta,11alpha,14alpha,20R,22R-hexahydroxy-5beta-cholest-7-en-6-one; Sa...	ALL 4 KN 2 LM 2	MS2		1

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MSnスペクトル情報

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