ピーク情報

ヒメツリガネゴケ　原糸体（プロトネマ）

pos

Peak #2425 MN MID: SE205_S03_M90

m/z: 727.40358, RT: 96.85, 強度: 3950, ログ強度: 0.24, アダクト: [M+Na]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (7 names) Cimiracemoside L;(-)-Cimiracemoside L;Soulieoside B;(+)-Soulieoside B;Hebelomic acid F;Soulieoside A;(+)-Soulieoside A

DBごとのヒット数: ALL 4 KN 4

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
C39H60O11	704.41356	1.126	Soulieoside B	KNApSAcK: C00032173
C39H60O11	704.41356	1.126	Cimiracemoside L	KNApSAcK: C00045775, C00045776
C39H60O11	704.41356	1.126	Hebelomic acid F	KNApSAcK: C00023932
C39H60O11	704.41356	1.126	Soulieoside A	KNApSAcK: C00032172 LipidMAPS: LMST01100007

MSnスペクトル情報

Level: 2, プリカーサーm/z: 727.40320

Splash: splash10-014i-0000390000-d0c3fb16cacf61566baf

m/z	Int.	NL	Rel.Int.
519.40	8015	208	1000
449.28	2952	278	368

Level: 3, プリカーサーm/z: 519.33289

Splash: splash10-0006-0190000000-c2ed50ae647fee97bd44

m/z	Int.	NL	Rel.Int.
243.12	70	276	1000
241.03	22	278	312
184.93	20	334	285
203.15	14	316	199
210.95	9	308	129
501.40	7	18	106
340.30	5	179	67
301.15	4	218	64

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Flavone]-A(2OH, 1(1(O-Malonyl)-C-Glu))-B(1OH)	Flavone	Vitexin 6''-O-malonate

Level: 3, プリカーサーm/z: 449.25635

Splash: splash10-0far-0198300000-a2bd6419637f86eecab3

m/z	Int.	NL	Rel.Int.
277.14	61	172	1000
383.27	56	66	918
287.12	50	162	813
303.12	43	146	708
431.28	27	18	441
405.31	25	44	408
369.19	18	80	287
275.26	17	174	270
342.97	15	106	240
241.32	12	208	191
173.07	11	276	173
421.18	9	28	154
305.13	9	144	143
345.20	9	104	141
297.25	8	152	125
243.13	6	206	91
184.27	4	265	71
143.03	4	306	69
340.11	4	109	63
259.00	3	190	53

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.083	[Flavone]-A(2OH, 1(C-Glu))-B(2OH)	Flavone	Isoorientin
0.083	[Flavone]-A(2OH, 1(C-Glu))-B(2OH)	Flavone	Orientin
0.083	[Flavonol]-A(1OH, 1(C-Glu))-B(2OH)	Flavonol	Fisetin 8-C-glucoside
0.083	[Flavonol]-A(2OH, 1(C-Glu))-B(1OH)	Flavonol	6-C-Glucopyranosylkaempferol
0.083	[Flavonol]-A(2OH, 1(C-Glu))-B(1OH)	Flavonol	8-C-beta-D-Glucopyranosylkaempferol
0.083	[Isoflavone]-A(2OH, 1(C-Glu))-B(2OH)	Isoflavone	6-C-Glucosylorobol
0.083	[Isoflavone]-A(2OH, 1(C-Glu))-B(2OH)	Isoflavone	8-C-Glucosylorobol
0.083	[Anthocyanidin]-A(2OH, 1(C-Glu))-B(2OH)	Anthocyanidin	8-C-Glucosylcyanidin
0.069	[Chalcone]-A(4OMe)-B(4OMe)	Chalcone	2,3,4,5,2',3',4',6'-Octamethoxychalcone
0.040	[Flavone]-A(4OMe)-B(1OH, 3OMe)	Flavone	Agehoustin C
0.000	[Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH)	Flavone	6-C-Galactosylluteolin
0.000	[Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH)	Flavone	8-C-Galactosylluteolin
0.000	[Flavone]-A(3OH, 1(C-Galactosyl))-B(1OH)	Flavone	6-C-Galactosylisoscutellarein
0.000	[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Cycloartomunin
0.000	[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1OMe)	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artomunoxanthone
0.000	[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1OMe)-B(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artonol E
0.000	[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Cycloartomunoxanthone
0.000	[UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone	Artonin P
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(1OH, 2OMe)	Flavonol	3'-Hydroxy-3,5,6,7,8,4',5'-heptamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(3OMe)	Flavonol	5-Hydroxy-3,6,7,8,3',4',5'-heptamethoxyflavone
0.000	[4-Hydroxy-3-phenylcoumarin]-A(1OMe, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	4-Hydroxy-3-phenylcoumarin	Lonchocarpenin

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
2425	96.85	727.40358	0.0000	0.24	[M+Na]+	(7 names) Cimiracemoside L; (-)-Cimiracemoside L; Soulieoside B; (+)-Soulieoside B; Hebelomic acid F; Soulieoside A; (+)-Soulieoside A	ALL 4 KN 4	MS2 MS3 x 2	2
	96.89	722.44847	-4.9551	0.74	[M+NH4]+	(7 names) Cimiracemoside L; (-)-Cimiracemoside L; Soulieoside B; (+)-Soulieoside B; Hebelomic acid F; Soulieoside A; (+)-Soulieoside A	ALL 4 KN 4		2
	96.89	705.42166	-21.9819	0.39	[M+H]+	(7 names) Cimiracemoside L; (-)-Cimiracemoside L; Soulieoside B; (+)-Soulieoside B; Hebelomic acid F; Soulieoside A; (+)-Soulieoside A	ALL 4 KN 4		2
	96.85	687.41101	-39.9926	0.67	[M-H2O+H]+	(7 names) Cimiracemoside L; (-)-Cimiracemoside L; Soulieoside B; (+)-Soulieoside B; Hebelomic acid F; Soulieoside A; (+)-Soulieoside A	ALL 4 KN 4		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

関連ピーク情報