ピーク情報

ヒメツリガネゴケ　茎葉体（ガメトフォア）

pos

Peak #2319 MN MID: SE205_S04_M90

m/z: 393.17535, RT: 40.76, 強度: 23224, ログ強度: 0.95, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: 2-[1-[(2S)-2-[[4-[(E)-N'-Hydroxycarbamimidoyl]benzoyl]amino]propanoyl]piperidin-4-yl]oxyacetic acid

DBごとのヒット数: ALL 1 HM 1

FlavonoidSearch最大スコア MS2: 0.020, 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
C18H24O6N4	392.16958	-3.853	2-[1-[(2S)-2-[[4-[(E)-N'-Hydroxycarbamimidoyl]benzoyl]amino]propanoyl]piperidin-4-yl]oxyacetic acid	HMDB: HMDB0257278

MSnスペクトル情報

Level: 2, プリカーサーm/z: 393.17480

Splash: splash10-0092-0922000000-69e0b1d28bd505fab24b

m/z	Int.	NL	Rel.Int.
175.04	3878	218	1000
173.99	3864	219	996
145.97	2870	247	740
365.36	2274	28	586
147.00	2217	246	571
347.23	1119	46	288
203.08	1084	190	279
192.10	877	201	226
375.27	865	18	223
193.12	717	200	184
238.09	582	155	150
173.08	552	220	142
114.02	533	279	137
221.04	522	172	134
220.02	473	173	121
202.02	472	191	121
212.06	390	181	100
190.93	389	202	100
213.14	357	180	91
237.14	293	156	75

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.121	[Flavanone]-A(1OH, 2(C-Prenyl))-B(1OH)	Flavanone	7,4'-Dihydroxy-6,8-di-C-prenylflavanone
0.121	[2'-Hydroxychalcone]-A(2OH, 2(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	4,2',4'-Trihydroxy-3',5'-diprenylchalcone
0.088	[Flavanone]-A(1OH)-B(1OH, 2(C-Prenyl))	Flavanone	7,4'-Dihydroxy-3',5'-di-C-prenylflavanone
0.088	[2'-Hydroxychalcone]-A(2OH)-B(1OH, 2(C-Prenyl))	2'-Hydroxychalcone	Abyssinone VI
0.088	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Kanzonol C
0.088	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Stipulin
0.088	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Flavanone	7,4'-Dihydroxy-8,3'-di-C-prenylflavanone
0.069	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Ficifolinol
0.069	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Erythrabyssin II
0.069	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Erybraedin C
0.069	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Erybraedin A
0.030	[Flavanone]-A(2OH, 2(C-Prenyl))-B(none)	Flavanone	5,7-Dihydroxy-6,8-di-C-prenylflavanone
0.000	[2'-Hydroxychalcone]-A(2OH, 1Geranyl)-B(1OH)	2'-Hydroxychalcone	Xanthoangelol
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano)))	2'-Hydroxychalcone	Artoindonesianin J
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano)))	2'-Hydroxychalcone	Bis(6'',6''-dimethyl-4'',5''-dihydropyrano)[2'',3'':4',5'][2'',3'':4,3]-2'-hydroxychalcone
0.000	[2'-Hydroxychalcone]-A(2OH, 1Geranyl)-B(1OH)	2'-Hydroxychalcone	Flemiwallichin E
0.000	[2'-Hydroxychalcone]-A(3OH, 1Geranyl)-B(none)	2'-Hydroxychalcone	3'-Geranyl-2',4',6'-trihydroxychalcone
0.000	[2'-Hydroxychalcone]-A(3OH, 1Neryl)-B(none)	2'-Hydroxychalcone	3'-Neryl-2',4',6'-trihydroxychalcone
0.000	[2'-Hydroxychalcone]-A(3OH, 1(6-Isopropyl-3-methyl-2-cyclohexenyl))-B(none)	2'-Hydroxychalcone	Linderachalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe, 1Br)-B(1OMe)	2'-Hydroxychalcone	3'-Bromo-6'-hydroxy-2',4,4'-trimethoxychalcone
0.000	[Dihydrochalcone]-A(2OH, 1OMe, 1(2-Hydroxybenzyl), 1Methyl)-B(none)	Dihydrochalcone	Anguvetin
0.000	[Flavanone]-A(1OH, 1Geranyl)-B(1OH)	Flavanone	Prostratol F
0.000	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano)))	Flavanone	Euchrenone a17
0.000	[Flavanone]-A(1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano)))	Flavanone	Dorsmanin B
0.000	[Flavanone]-A(2OH, 1Geranyl)-B(none)	Flavanone	5,7-Dihydroxy-8-C-geranylflavanone
0.000	[Flavanone]-A(2OH, 1(6-Isopropyl-3-methyl-2-cyclohexenyl))-B(none)	Flavanone	Linderatone
0.000	[Flavone]-A(1([2,3:@@]-(5,5-Dimethyl-4-acetoxy-4,5,3a,6a-tetrahydro-furo[2,3-b]furano)))-B(none)	Flavone	Semiglabrin
0.000	[Flavone]-A(1OH, 1OMe, 1(5-hydroxy-6-methyl-4-oxo-4H-pyran-3-yl))-B(none)	Flavone	Hosloppin
0.000	[Flavone]-A(2OMe, 1(2,5-Dihydro-5,5-dimethyl-2-oxo-3-furanyl))-B(none)	Flavone	Hookerianin
0.000	[Flavone]-A(1OMe, 1([5,4:@@]-(2,2-Dimethyldihydro-3-oxofuro[2,3-c]pyrano)))-B(none)	Flavone	Stachyoidin
0.000	[Flavonol]-A(2OH, 1(p-Hydroxybenzyl))-B(1OH)	Flavonol	8-C-p-Hydroxybenzylkaempferol
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(3OH)	Flavonol	5,7,3',4',5'-Pentahydroxy-3,6,8-trimethoxyflavone
0.000	[Flavan]-A(1OH)-B(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavan	Kazinol B
0.000	[Isoflavan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1(C-Prenyl))	Isoflavan	Hispaglabridin A
0.000	[6a-substituted Pterocarpan (6a-C-Prenyl)]-A(1OH)-B(1OH, 1(C-Prenyl))	6a-substituted Pterocarpan	Lespein
0.000	[Pterocarpan]-A(1OH)-B(1OH, 1Geranyl)	Pterocarpan	Lespedezin
0.000	[Dehydrorotenone]-A(1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe)	Dehydrorotenone	Dehydrorotenone
0.000	[Dehydrorotenone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	Dehydrorotenone	Dehydrodeguelin,7a,13a-Didehydrodeguelin
0.000	[4-phenylcoumarin]-A(2OH, 1(C-Prenyl), 1Butyroyl)-B(none)	4-phenylcoumarin	6-Butyryl-5,7-dihydroxy-8-prenyl-4-phenylcoumarin
0.000	[4-phenylcoumarin]-A(2OH, 1(C-Prenyl), 1Isobutyroyl)-B(none)	4-phenylcoumarin	Mesuol

Level: 3, プリカーサーm/z: 173.99460

Splash: splash10-0002-0900000000-ef6428e04406d2d05900

m/z	Int.	NL	Rel.Int.
145.99	3147	28	1000

Level: 3, プリカーサーm/z: 175.03732

Splash: splash10-0002-0900000000-a56f0af43f4fcf58ca9e

m/z	Int.	NL	Rel.Int.
147.01	2494	28	1000
145.93	364	29	145
157.13	150	18	60

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	共有数
2319	40.76	393.17535	0.0000	0.95	[M+H]+	2-[1-[(2S)-2-[[4-[(E)-N'-Hydroxycarbamimidoyl]benzoyl]amino]propanoyl]piperidin-4-yl]oxyacetic acid	ALL 1 HM 1	MS2 MS3 x 2	0.020	3
	40.74	375.16495	-18.0104	0.43	[M-H2O+H]+	2-[1-[(2S)-2-[[4-[(E)-N'-Hydroxycarbamimidoyl]benzoyl]amino]propanoyl]piperidin-4-yl]oxyacetic acid	ALL 1 HM 1	MS2 MS3	0.091	3
	40.78	357.15428	-36.0211	0.41	[M-2(H2O)+H]+	2-[1-[(2S)-2-[[4-[(E)-N'-Hydroxycarbamimidoyl]benzoyl]amino]propanoyl]piperidin-4-yl]oxyacetic acid	ALL 1 HM 1			2

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

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