ピーク情報

パセリ　根

pos

Peak #3639 MN MID: SE61_S24_M90

m/z: 373.11287, RT: 38.60, 強度: 6448, ログ強度: 0.31, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 5

DB検索結果: (7 names) Deacetyl asperuloside;Deacetylasperuloside;Randioside;Dihydroferulic acid 4-O-glucuronide;Dihydroisoferulic acid 3-glucuronide;Veranisatin C;Cycloshermilamine D

DBごとのヒット数: ALL 6 KN 4 HM 2

FlavonoidSearch最大スコア MS2: 0.074, MS3: 0.333

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
C16H20O10	372.10565	-0.145	Deacetyl asperuloside	KNApSAcK: C00030092
C16H20O10	372.10565	-0.145	Randioside	KNApSAcK: C00010669
C16H20O10	372.10565	-0.145	Dihydroferulic acid 4-O-glucuronide	HMDB: HMDB0041723
C16H20O10	372.10565	-0.145	Dihydroisoferulic acid 3-glucuronide	HMDB: HMDB0240497
C16H20O10	372.10565	-0.145	Veranisatin E	HMDB: HMDB0031756 KNApSAcK: C00047358
C21H16ON4S	372.10448	2.985	Cycloshermilamine D	KNApSAcK: C00047035

MSnスペクトル情報

Level: 2, プリカーサーm/z: 373.11215

Splash: splash10-0a4l-0019000000-182c0d3eb8b63c95d8c5

m/z	Int.	NL	Rel.Int.
355.13	787	18	1000
342.96	543	30	689
219.01	155	154	197
211.09	122	162	155
325.24	91	48	116
364.18	59	9	74
336.96	50	36	63
201.07	42	172	53
311.26	40	62	50

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.074	[Isoflavone]-A(2OMe)-B(3OMe)	Isoflavone	6,7,3',4',5'-Pentamethoxyisoflavone
0.074	[Isoflavone]-A(2OMe)-B(3OMe)	Isoflavone	6,7,2',3',4'-Pentamethoxyisoflavone
0.074	[Isoflavone]-A(2OMe)-B(3OMe)	Isoflavone	6,7,2',4',5'-Pentamethoxyisoflavone
0.074	[Isoflavone]-A(2OMe)-B(3OMe)	Isoflavone	Robustigenin methyl ether
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	Prosogerin C
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	7,8,3',4',5'-Pentamethoxyflavone
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	5,6,2',3',6'-Pentamethoxyflavone
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	Cerosilin B
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	5,6,2',3',4'-Pentamethoxyflavone
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	Tricetin 5,7,3',4',5'-pentamethyl ether
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	5,7,2',3',4'-Pentamethoxyflavone
0.071	[Flavone]-A(2OMe)-B(3OMe)	Flavone	5,7,2',4',6'-Pentamethoxyflavone
0.071	[Flavone]-A(3OMe)-B(2OMe)	Flavone	Sinensetin
0.071	[Flavone]-A(3OMe)-B(2OMe)	Flavone	Isosinensetin
0.071	[Flavone]-A(4OMe)-B(1OMe)	Flavone	Tangeretin
0.050	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(2OH)	Dihydroflavonol	6-Prenyltaxifolin
0.000	[2'-Hydroxychalcone]-A(2OH)-B(1([2,3:@@]-(5-(p-Hydroxyphenyl)furano)))	2'-Hydroxychalcone	Lophirone E
0.000	[beta-Hydroxy(or Oxodihydro)chalcone (2-OMe)]-A(1([@@]-Methylenedioxy))-B(3OMe)	beta-Hydroxy(or Oxodihydro)chalcone	3',4'-Methylenedioxy-2,4,6,beta-tetramethoxychalcone
0.000	[Flavanone]-A(1OH)-B(1([2,3:@@]-(5-(p-Hydroxyphenyl)furano)))	Flavanone	7-Hydroxy-(5-(p-Hydroxyphenyl)furano)[2,3:4',3'])flavanone
0.000	[Flavanone]-A(2OH, 1((E)-4-Hydroxyprenyl))-B(2OH)	Flavanone	Licoleafol
0.000	[Flavanone]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))	Flavanone	Sigmoidin D
0.000	[3-substituted Flavone (3-(3-Methylbutyl))]-A(2OH)-B(3OH)	3-substituted Flavone	Asplenetin
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(1OMe)	Flavonol	Auranetin
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(2OMe)	Flavonol	3,5,7,2',6'-Pentamethoxyflavone
0.000	[Flavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Flavonol	6-(3-hydroxy-3-methylbutyl)kaempferol
0.000	[Flavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Flavonol	Noricaritin
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(2OMe)	Flavonol	Quercetin pentamethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe, 1Methyl)-B(2OMe)	Flavonol	2-(3,4-Dimethoxyphenyl)-5-hydroxy-3,7-dimethoxy-6-methyl-4H-1-benzopyran-4-one
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe, 2Methyl)-B(1OH, 1OMe)	Flavonol	5,4'-Dihydroxy-3,7,3'-trimethoxy-6,8-dimethylflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Flavonol	Melisimplin
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(1OMe)	Flavonol	Herbacetin pentamethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Flavonol	7-Hydroxy-3,5,8-trimethoxy-3',4'-methylenedioxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Flavonol	5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(none)	Flavonol	3,5,6,7,8-Pentamethoxyflavone
0.000	[Flavan 3,4-diol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavan 3,4-diol	3,4,7,4'-Tetrahydroxy-5-methoxy-8-prenylflavan
0.000	[Isoflavone]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(2OH)	Isoflavone	2,3-Dehydrokievitone hydrate
0.000	[Isoflavanone]-A(2OH, 1((Z)-4-hydroxyprenyl))-B(2OH)	Isoflavanone	Kievitol
0.000	[6-Hydroxydehydrorotenone]-A(3OH)-B(1OH)-C(1(O-Acetyl))	6-Hydroxydehydrorotenone	3,6,9,10,11-Pentahydroxydehydrorotenone 6-O-acetate
0.000	[6-Hydroxydehydrorotenone]-A(1OH, 1OMe)-B(2OMe)	6-Hydroxydehydrorotenone	Stemonal

Level: 3, プリカーサーm/z: 355.20624

Splash: splash10-03dr-0159000000-734a981098f64eadbe8d

m/z	Int.	NL	Rel.Int.
313.25	77	42	1000
201.13	48	154	617
337.08	38	18	498
285.22	16	70	202
323.42	13	32	172
311.30	13	44	164
231.07	9	124	115
161.28	9	194	115
242.31	9	113	110
319.00	7	36	91
179.26	7	176	88
221.09	5	134	62
304.95	5	50	62
281.18	4	74	56
124.62	4	231	52

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.333	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavone	5,7,3',4'-Tetrahydroxy-6-prenylisoflavone
0.333	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavone	Gancaonin L
0.333	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavone	Luteone (isoflavone)
0.333	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavone	2,3-Dehydrokievitone
0.292	[Flavone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavone	8-C-Prenylluteolin
0.292	[Flavone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavone	6-C-Prenylluteolin
0.292	[Flavone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavone	Artocarpesin
0.250	[Flavanone]-A(2OH, 1(C-Prenyl))-B(1OMe)	Flavanone	5,7-Dihydroxy-4'-methoxy-8-C-prenylflavanone
0.250	[Flavanone]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Sigmoidin C
0.250	[Flavanone]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Sanggenon F
0.250	[Flavanone]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Sanggenon H
0.240	[Chalcone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl))	Chalcone	Licoagrochalcone C
0.240	[Chalcone]-A(1OH, 1(C-Prenyl))-B(2OH, 1OMe)	Chalcone	Licochalcone D
0.233	[Flavonol]-A(3OH, 1(C-Prenyl))-B(none)	Flavonol	Platanetin
0.231	[Isoflavone]-A(2OH)-B(2OH, 1(C-Prenyl))	Isoflavone	Licoisoflavone A
0.226	[Flavonol]-A(2OH)-B(1OH, 1(C-Prenyl))	Flavonol	Isolicoflavonol
0.226	[Flavonol]-A(2OH, 1(C-Prenyl))-B(1OH)	Flavonol	6-Prenylkaempferol
0.226	[Flavonol]-A(2OH, 1(C-Prenyl))-B(1OH)	Flavonol	Noranhydroicaritin
0.174	[Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(none)	Dihydroflavonol	Leaserone
0.160	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Xanthohumol
0.160	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Xanthogalenol
0.154	[Flavanone]-A(2OH, 1OMe, 1(C-Prenyl))-B(none)	Flavanone	Agrandol
0.154	[Flavanone]-A(2OH, 1OMe, 1(C-Prenyl))-B(none)	Flavanone	Microfolione
0.154	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavanone	5,4'-Dihydroxy-7-methoxy-6-C-prenylflavanone
0.154	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavanone	Isoxanthohumol(Sophora)
0.154	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavanone	Mundulea flavanone B
0.150	[Dihydroflavonol]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Dihydroflavonol	3,5,4'-Trihydroxy-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone
0.136	[Isoflavanone]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavanone	Licoisoflavanone
0.130	[Pterocarpan]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Pterocarpan	Edudiol
0.087	[Isoflavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavanone	Cyclokievitone
0.083	[Pterocarpan]-A(1OH, 1OMe)-B(1OH, 1(C-Prenyl))	Pterocarpan	1-Methoxyphaseollidin
0.000	[2-Benzyl-2-hydroxydihydrobenzofuran (2,3-OMe)]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	2-Benzyl-2-hydroxydihydrobenzofuran	Castillene C
0.000	[Chalcone]-A(1OH)-B(1OMe, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))	Chalcone	Licoagrochalcone D
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	2'-Hydroxychalcone	Xanthoangelol D
0.000	[2'-Hydroxychalcone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(1OH)	2'-Hydroxychalcone	Xanthoangelol H
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	Helichromanochalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	2'-Methoxyhelikrausichalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	6'',6''-Dimethyl-5''-hydroxy-4'',5''-dihydropyrano[2'',3'':2',3']-4'-hydroxy-6'-methoxychalcone
0.000	[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6-Methyl-4,7-dihydrooxepino)))-B(2OH)	2'-Hydroxychalcone	3',4'-Dihydrooxepino-6'-hydroxybutein
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	2'-Hydroxychalcone	Isodehydrocycloxanthohumol hydrate
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(2OH, 1OMe, 1(C-Prenyl))-B(none)	beta-Hydroxy(or Oxodihydro)chalcone	3'-Prenyl-2',6',beta-trihydroxy-4'-methoxychalcone
0.000	[Dihydrochalcone]-A(2OH, 1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Dihydrochalcone	Flemistrictin D
0.000	[Dihydrochalcone beta-ol (beta-OMe)]-A(1OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Dihydrochalcone beta-ol	Ponganone IX
0.000	[Flavanone]-A(1OH, 1OMe, 1(3-Hydroxy-3-methyl-1-butenyl))-B(none)	Flavanone	Tephroleocarpin A
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Methyl)-B(1OH)	Flavanone	5,7,4'-Trihydroxy-6-methyl-8-prenylflavanone
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Methyl)-B(1OH)	Flavanone	5,7,4'-Trihydroxy-8-methyl-6-prenylflavanone
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OH)	Flavanone	Velloeriodictyol
0.000	[Flavanone]-A(1OH, 1OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Flavanone	5-Hydroxy-6-methoxy-3',4'-methylenedioxyfurano[2'',3'':7,8]flavanone
0.000	[Flavone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	Flavone	Dinklagin C
0.000	[Flavone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	Flavone	Ephedroidin
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(1OH)	Flavone	Dinklagin B
0.000	[3-substituted Flavone (3-C-Prenyl)]-A(2OH)-B(2OH)	3-substituted Flavone	Albanin A
0.000	[Dihydroflavonol]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH)	Dihydroflavonol	Shuterol
0.000	[Dihydroflavonol]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH)	Dihydroflavonol	3,5,4'-Trihydroxy-4'',5'',dihydro-5''-isopropenylfurano[2'',3'':7,8]flavanone
0.000	[Dihydroflavonol (3-OMe)]-A(2OMe, 1([2,3:@@]-Furano))-B(none)	Dihydroflavonol	3,5,6-Trimethoxy-[2'',3'':7,8]furanoflavanone
0.000	[Flavan 3-ol]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavan 3-ol	7,8-(2,2-Dimethylpyrano)-3,4'-dihydroxy-5-methoxyflavan
0.000	[Flavan 4-ol]-A(2OMe, 1(C-Prenyl))-B(none)	Flavan 4-ol	Tephrowatsin A
0.000	[Flavan 3,4-diol]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavan 3,4-diol	Quercetol A
0.000	[CCS-type derivative / [2,3,4:5,4a,4]-(6-Carboxypyrano)anthocyanidin]-A(1OH)-B(2OH)	CCS-type derivative / [2,3,4:5,4a,4]-(6-Carboxypyrano)anthocyanidin	5-Carboxypyranocyanidin
0.000	[Isoflavone]-A(2OH, 1((Z)-4-hydroxyprenyl))-B(1OH)	Isoflavone	Hydroxywighteone
0.000	[Isoflavone]-A(2OH, 1((Z)-4-hydroxyprenyl))-B(1OH)	Isoflavone	Gancaonin C
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1OH)	Isoflavone	Erythrinin C
0.000	[Isoflavone]-A(2OH)-B(1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))	Isoflavone	Lupinisoflavone C
0.000	[Isoflavone]-A(2OH)-B(2OH, 1(1,1-Dimethylallyl))	Isoflavone	Fremontin
0.000	[Isoflavanone]-A(1([2,3:@@]-Furano))-B(1OH, 1OMe, 1([@@]-Methylenedioxy))	Isoflavanone	Erosenone
0.000	[Isoflavanone]-A(1([2,3:@@]-Furano))-B(3OMe)	Isoflavanone	Nepseudin
0.000	[Isoflavanone]-A(1([2,3:@@]-Furano))-B(3OMe)	Isoflavanone	Ambonone
0.000	[Isoflavan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1OMe)	Isoflavan	3'-Methoxyglabridin
0.000	[Isoflavan]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavan	Neorauflavane
0.000	[Pterocarpan-6a-ol]-A(1OH)-B(1OMe, 1(C-Prenyl))	Pterocarpan-6a-ol	Cristacarpin
0.000	[Pterocarpan-6a-ol]-A(1OMe, 1(C-Prenyl))-B(1OH)	Pterocarpan-6a-ol	Glyceollin IV
0.000	[Pterocarpan-6a-ol]-A(1([2,3:@@]-(5-(Hydroxyisopropanyl)furano)))-B(1OH)	Pterocarpan-6a-ol	Glyceofuran
0.000	[Rotenoid 12-ol]-A(1([2,3:@@]-Furano))-B(2OMe)	Rotenoid 12-ol	Elliptinol
0.000	[3-Hydroxy-2-phenylbenzofuran (3-OMe)]-A(1OH, 1(C-Prenyl))-B(1OH, 1OMe)	3-Hydroxy-2-phenylbenzofuran	Ambofuranol
0.000	[2-Phenylbenzofuran]-A(2OMe, 1(C-Prenyl))-B(2OH)	2-Phenylbenzofuran	Gancaonin I