ピーク情報

よもぎ葉生

pos

Peak #1297 MN MID: SE116_S063011_M90

m/z: 441.12358, RT: 13.12, 強度: 149422, ログ強度: 1.69, アダクト: [2M+H]+, [M+IsoProp+H]+, 共有数（同様のピークを含むサンプル数）: 16

DB検索結果: (9 names) 3-Hydroxy-3-carboxymethyl-adipic acid;1,5-Dimethyl citrate;(-)-threo-Iso(homo)2-citrate;(-)-threo-1-Hydroxy-1,2,5-pentanetricarboxylic acid;1-Hydroxypentane-1,2,5-tricarboxylate;threo-(Homo)2-isocitra...

DBごとのヒット数: ALL 4 KG 2 HM 2

FlavonoidSearch最大スコア MS2: -, MS3: -

MSnスペクトル情報

Level: 2, プリカーサーm/z: 441.12238

Splash: splash10-00di-0090000000-8eb210cd47c0a3e7501c

m/z	Int.	NL	Rel.Int.
220.90	30142	220	1000
166.92	2347	274	77

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(2OH, 2(C-Prenyl))-B(3OH)	Flavanone	Kenusanone B
[Dihydroflavonol]-A(2OH, 2(C-Prenyl))-B(2OH)	Dihydroflavonol	Kushenol L
[Dihydrochalcone]-A(3OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl))	Dihydrochalcone	3,2',4',6'-Tetrahydroxy-4-methoxy-3',5-diprenyldihydrochalcone
[Dihydrochalcone]-A(2OH, 1OMe, 1Geranyl)-B(2OH)	Dihydrochalcone	3'-Geranyl-3,4,2',4'-tetrahydroxy-6'-methoxydihydrochalcone
[Flavanone]-A(2OH, 1(C-Prenyl))-B(1OMe, 1(3-Hydroxy-3-methylbutyl))	Flavanone	5,7-Dihydroxy-4'-methoxy-8-C-prenyl-3'-(3-hydroxy-3-methylbutyl)flavanone
[Flavanone]-A(2([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)) )-B(1OH)	Flavanone	Lonchocarpol E
[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(2,3-Dihydroxy-3-methylbutyl))-B(1OH)	Flavanone	2'',3''-Dihydroxylupinifolin
[Flavanone]-A(2OH, 1(C-Prenyl), 1(2-hydroxy-3-methyl-3-butenyl))-B(2OH)	Flavanone	Dorsmanin H
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(2OH)	Flavanone	Dorsmanin F
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(2OH)	Flavanone	Dorsmanin G
[Flavanone]-A(2OH)-B(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))	Flavanone	Abyssinoflavanone V
[Flavanone]-A(2OH)-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano)), 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))	Flavanone	Abyssinoflavanone VI
[Flavanone]-A(2OH, 1Geranyl)-B(3OH)	Flavanone	Sophoraflavanone D
[Flavanone]-A(2OH, 1Geranyl)-B(3OH)	Flavanone	Sophoraflavanone E
[Flavanone]-A(2OH, 1Lavandulyl)-B(3OH)	Flavanone	Exiguaflavanone C
[Flavanone]-A(2OH, 1Lavandulyl)-B(3OH)	Flavanone	Exiguaflavanone G
[Dihydroflavonol]-A(2OH, 1Geranyl)-B(2OH)	Dihydroflavonol	Diplacol
[Dihydroflavonol]-A(2OH, 1Lavandulyl)-B(2OH)	Dihydroflavonol	Kushenol X
[Flavan 3-ol]-A(1OH)-B(3OH)	Flavan 3-ol	6a,12b-Dihydro-3,10,11,12-tetrahydroxy-6-(3,4,5-trihydroxyphenyl)-[2]benzopyrano[3,4-c]benzopyran-8(6H)-one
[Flavan 3-ol]-A(2OH)-B(1OH, 1([3,4:@@]-(5,6,7-Trihydroxy-1-oxoisochromene)))	Flavan 3-ol	Amurensisin
[12a-Hydroxyrotenone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	12a-Hydroxyrotenone	12a-Hydroxyerythynone

Level: 3, プリカーサーm/z: 220.90457

Splash: splash10-03di-0900000000-8f1f82219a4b3a8a5b10

m/z	Int.	NL	Rel.Int.
112.98	1713	108	1000
184.91	245	36	143
202.86	186	18	108
167.07	87	54	50

Level: 3, プリカーサーm/z: 166.92477

Splash: splash10-0229-0900000000-64db3ba8b577ca06e3f9

m/z	Int.	NL	Rel.Int.
120.80	410	46	1000
110.94	233	56	566
148.95	138	18	335
138.96	132	28	321
82.95	58	84	140
136.96	37	30	90
109.10	31	58	74
94.93	27	72	65
54.72	21	112	50

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
	13.11	479.07928	37.9557	0.84	[2M+K]+	(11 names) 3-Hydroxy-3-carboxymethyl-adipic acid; 1,5-Dimethyl citrate; (-)-threo-Iso(homo)2-citrate; (-)-threo-1-Hydroxy-1,2,5-pentanetricarboxylic acid; 1-Hydroxypentane-1,2,5-tricarboxylate; threo-(Homo)2-isocitra...	ALL 6 KG 2 KN 1 HM 3				4
1297	13.12	441.12358	0.0000	1.69	[2M+H]+, [M+IsoProp+H]+	(9 names) 3-Hydroxy-3-carboxymethyl-adipic acid; 1,5-Dimethyl citrate; (-)-threo-Iso(homo)2-citrate; (-)-threo-1-Hydroxy-1,2,5-pentanetricarboxylic acid; 1-Hydroxypentane-1,2,5-tricarboxylate; threo-(Homo)2-isocitra...	ALL 4 KG 2 HM 2	MS2 MS3 x 2			16

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MSnスペクトル情報

FlavonoidSearch結果

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