ピーク情報

パセリ　根

pos

Peak #4522 MN MID: SE61_S24_M90

m/z: 517.17067, RT: 43.39, 強度: 14909, ログ強度: 0.68, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (12 names) Epimedoside C;Jasmolactone D;Sinocrassoside A2;(-)-Sinocrassoside A2;Vitexin 2''-O-(2'''-methylbutyryl);Iicoisoflavone A 7-O-glucoside;5,7,2',4'-Tetrahydroxy-3'-prenylisoflavone 7-O-glucoside;((2R,3S,...

DBごとのヒット数: ALL 9 KG 1 KN 7 HM 1

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
C26H28O11	516.16316	0.448	Epimedoside C	FlavonoidViewer: FL5FAAGI0003 KNApSAcK: C00005806 LipidMAPS: LMPK12111711
C26H28O11	516.16316	0.448	Jasmolactone D	KNApSAcK: C00010770
C26H28O11	516.16316	0.448	Sinocrassoside A2	KNApSAcK: C00032124
C26H28O11	516.16316	0.448	2''-O-(2'''-Methylbutyryl)vitexin	FlavonoidViewer: FL3FAACS0086 KNApSAcK: C00014087 LipidMAPS: LMPK12110276
C26H28O11	516.16316	0.448	((2R,3S,4S,5R,6S)-6-(2-(3-(Benzofuran-5-yl)propanoyl)-3-hydroxy-5-methylphenoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl methyl carbonate	HMDB: HMDB0242227
C26H28O11	516.16316	0.448	Iicoisoflavone A 7-O-glucoside	KNApSAcK: C00019702
C26H28O11	516.16316	0.448	Iuteone 7-O-glucoside	HMDB: HMDB0039316 KNApSAcK: C00019701
C26H28O11	516.16316	0.448	Iicoisoflavone A 4'-O-glucoside	KNApSAcK: C00019703
C18H32O13N2S	516.16251	1.711	S-(Hydroxymethyl)mycothiol	KEGG: C18235

MSnスペクトル情報

Level: 2, プリカーサーm/z: 517.16968

Splash: splash10-01q0-0049200000-9d0433cfff4a4b25af84

m/z	Int.	NL	Rel.Int.
231.15	1132	286	1000
311.18	937	206	828
337.18	599	180	529
499.35	373	18	329
355.12	346	162	305
387.19	304	130	268
388.28	155	129	137
498.42	127	19	112
187.00	125	330	110
473.13	114	44	100
309.16	99	208	87
279.15	82	238	72
452.25	80	65	70

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Feruloyl)-(Z)-4-hydroxyprenyl))-B(1OH)	2'-Hydroxychalcone	Gemichalcone A
[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl))-B(none)	2'-Hydroxychalcone	Rottlerin
[Flavone]-A(2OH, 1(1(O-<2-Methylbutyroyl>)-C-Glu))-B(1OH)	Flavone	Vitexin 2''-O-(2'''-methylbutyryl)
[Flavone]-A(2OH, 1(2(O-Acetyl)-C-Glu))-B(1OH)	Flavone	2'',6''-Di-O-Acetylisovitexin
[Dihydroflavonol]-A(2OH, 2(p-Hydroxybenzyl) )-B(2OH)	Dihydroflavonol	Gericudranin A

Level: 3, プリカーサーm/z: 311.17896

Splash: splash10-004i-0390000000-fd14bce6b84715b02f64

m/z	Int.	NL	Rel.Int.
279.06	500	32	1000
187.08	161	124	322
251.21	147	60	294
149.08	63	162	125
160.99	55	150	109
283.23	53	28	106
280.20	46	31	91
296.24	41	15	81
189.19	35	122	70

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2-Benzyl-2-hydroxydihydrobenzofuran (2,3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	2-Benzyl-2-hydroxydihydrobenzofuran	Castillene B
[Dihydrochalcone beta-ol (beta-OMe)]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Dihydrochalcone beta-ol	Ovalitenin B
[Flavone]-A(2OH, 1(2-Oxoethyl))-B(none)	Flavone	6-(2-Oxoethyl)-5,7-dihydroxyflavone
[Isoflavone]-A(1([@@]-Methylenedioxy))-B(1([@@]-Methylenedioxy))	Isoflavone	Maximaisoflavone A
[Coumestan]-A(1OMe)-B(1([@@]-Methylenedioxy))	Coumestan	Flemichapparin C

Level: 3, プリカーサーm/z: 231.15329

Splash: splash10-03di-0590000000-97b1b8120d3a81b484fb

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

m/z	Int.	NL	Rel.Int.
213.12	494	18	1000
187.07	210	44	424
159.15	55	72	112
171.91	45	59	91
203.14	32	28	64