ピーク情報

（かんきつ類）レモン全果生

pos

Peak #6687 MN MID: SE123_S071551_M90

m/z: 547.23884, RT: 60.12, 強度: 21061, ログ強度: 0.79, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (2 names) Cucurbitoside J;(-)-Cucurbitoside J

DBごとのヒット数: ALL 1 KN 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.125

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
C25H38O13	546.23124	0.589	Cucurbitoside J	KNApSAcK: C00042422

MSnスペクトル情報

Level: 2, プリカーサーm/z: 547.23822

Splash: splash10-002f-0009310000-d80dd65778a82b9e9f85

m/z	Int.	NL	Rel.Int.
393.00	895	154	1000
375.13	547	172	611
529.27	214	18	239
469.31	192	78	214
410.82	158	136	176
249.09	145	298	162
528.46	99	19	110
487.11	84	60	94
369.30	65	178	72
451.29	56	96	62
423.23	52	124	57

Level: 3, プリカーサーm/z: 392.99719

Splash: splash10-004i-0039000000-3ed8b92b64edf439e5be

m/z	Int.	NL	Rel.Int.
375.06	91	18	1000
291.07	37	102	408
356.92	13	36	145
213.16	6	180	64

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.125	[Flavanone]-A(2OH, 2(C-Prenyl))-B(none)	Flavanone	5,7-Dihydroxy-6,8-di-C-prenylflavanone
0.105	[Flavanone]-A(1OH, 2(C-Prenyl))-B(1OH)	Flavanone	7,4'-Dihydroxy-6,8-di-C-prenylflavanone
0.105	[2'-Hydroxychalcone]-A(2OH, 2(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	4,2',4'-Trihydroxy-3',5'-diprenylchalcone
0.105	[Flavanone]-A(1OH)-B(1OH, 2(C-Prenyl))	Flavanone	7,4'-Dihydroxy-3',5'-di-C-prenylflavanone
0.105	[2'-Hydroxychalcone]-A(2OH)-B(1OH, 2(C-Prenyl))	2'-Hydroxychalcone	Abyssinone VI
0.105	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Kanzonol C
0.105	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Stipulin
0.105	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Flavanone	7,4'-Dihydroxy-8,3'-di-C-prenylflavanone
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Ficifolinol
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Erythrabyssin II
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Erybraedin C
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpan	Erybraedin A
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: 375.13086

Splash: splash10-053i-0296000000-91c0881936819358a217

m/z	Int.	NL	Rel.Int.
231.05	69	144	1000
338.93	48	36	687
357.07	47	18	674
235.02	34	140	494
127.01	23	248	326
212.98	14	162	198
192.99	14	182	195
217.07	11	158	152
211.36	9	164	122
321.08	7	54	103
253.11	7	122	93
147.03	4	228	60

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.105	[2'-Hydroxychalcone]-A(1OH, 3OMe)-B(2OMe)	2'-Hydroxychalcone	6'-Hydroxy-3,4,2',3',4'-pentamethoxychalcone
0.105	[2'-Hydroxychalcone]-A(1OH, 3OMe)-B(2OMe)	2'-Hydroxychalcone	2'-Hydroxy-3',4',6',3,4-pentamethoxychalcone
0.095	[Flavanone]-A(3OMe)-B(2OMe)	Flavanone	5,6,7,3',4'-Pentamethoxyflavanone
0.095	[Flavanone]-A(2OMe)-B(3OMe)	Flavanone	5,7,2',3',4'-Pentamethoxyflavanone
0.067	[Isoflavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Isoflavone	5,3'-Dihydroxy-6,7,8,2'-tetramethoxyisoflavone
0.050	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(3OMe)	2'-Hydroxychalcone	2'-Hydroxy-3,4,5,4',6'-pentamethoxychalcone
0.050	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(3OMe)	2'-Hydroxychalcone	Rubone
0.045	[Flavanone]-A(4OMe)-B(1OMe)	Flavanone	5,6,7,8,4'-Pentamethoxyflavanone
0.037	[Flavonol]-A(1OH, 3OMe)-B(1OMe)	Flavonol	Eriostemin
0.037	[Flavonol]-A(1OH, 3OMe)-B(1OMe)	Flavonol	3,5-Dihydroxy-6,7,8,4'-tetramethoxyflavone
0.037	[Flavonol]-A(3OMe)-B(1OH, 1OMe)	Flavonol	Eupatoretin
0.032	[Isoflavone]-A(2OH, 1OMe)-B(3OMe)	Isoflavone	Junipegenin C
0.032	[Isoflavone]-A(2OH, 1OMe)-B(3OMe)	Isoflavone	Caviunin
0.032	[Isoflavone]-A(2OH, 1OMe)-B(3OMe)	Isoflavone	Isocaviunin
0.000	[Flavone]-A(1OH, 1OMe)-B(1OH, 3OMe)	Flavone	5,3'-Dihydroxy-7,2',4',5'-tetramethoxyflavone
0.000	[Flavone]-A(1OH, 1OMe)-B(1OH, 3OMe)	Flavone	5,4'-Dihydroxy-7,2',3',5'-tetramethoxyflavone
0.000	[Flavone]-A(2OH)-B(4OMe)	Flavone	5,7-Dihydroxy-2',3',4',5'-tetramethoxyflavone
0.000	[Flavone]-A(2OH, 1OMe)-B(3OMe)	Flavone	Arteanoflavone
0.000	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,4'-Dihidroxy-6,7,3',5'-tetramethoxyflavone
0.000	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,3'-Dihydroxy-6,7,4',5'-tetramethoxyflavone
0.000	[Flavone]-A(2OH, 1OMe)-B(3OMe)	Flavone	Tabularin
0.000	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,3'-Dihydroxy-7,8,4',5'-tetramethoxyflavone
0.000	[Flavone]-A(2OH, 1OMe)-B(3OMe)	Flavone	5,7-Dihydroxy-8,3',4',5'-tetramethoxyflavone
0.000	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,4'-Dihidroxy-7,8,2',3'-tetramethoxyflavone
0.000	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	Skullcapflavone II
0.000	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	8,3'-Dihydroxy-5,6,7,4'-tetramethoxyflavone
0.000	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	7-Methylsudachitin
0.000	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	Gardenin D
0.000	[Flavone]-A(2OH, 2OMe)-B(2OMe)	Flavone	Hymenoxin
0.000	[Flavone]-A(2OH, 2OMe)-B(2OMe)	Flavone	Pebrellin
0.000	[Flavonol]-A(1OH, 1OMe)-B(3OMe)	Flavonol	3,5-Dihydroxy-7,3',4',5'-tetramethoxyflavone
0.000	[Flavonol]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Quercetagetin 6,7,3'4'-tetramethyl ether
0.000	[Flavonol]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Gossypetin 7,8,3',4'-tetramethyl ether
0.000	[2'-Hydroxychalcone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	2'-Hydroxychalcone	Spinochalcone C
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(none)	2'-Hydroxychalcone	Spinochalcone B
0.000	[Flavanone]-A(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	8-C-Prenyl-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone
0.000	[Flavanone]-A(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	Maximaflavanone A
0.000	[Flavanone]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(2OH)	Flavanone	6-C-(3-Hydroxyisopentyl)eriodictyol
0.000	[Dihydroflavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Dihydroflavonol	8-(3-hydroxy-3-methylbutyl)aromadendrin
0.000	[Dihydroflavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Dihydroflavonol	6-(3-Hydroxy-3-methylbutyl)aromadendrin
0.000	[Dihydroflavonol]-A(2OH, 1(3-Oxobutyl))-B(2OH)	Dihydroflavonol	6-(3''-Oxobutyl)taxifolin
0.000	[Dihydroflavonol]-A(1OH, 2OMe)-B(1OH)-C(1(O-Acetyl))	Dihydroflavonol	3,5,2'-Trihydroxy-7,8-dimethoxyflavanone 3-O-acetate
0.000	[Flavonol (3-OMe)]-A(2OH)-B(3OMe)	Flavonol	Myricetin 3,3',4',5'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Myricetin 3,7,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	5,5'-Dihydroxy-3,7,3',4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Myricetin 3,7,3',5'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 2Methyl)-B(2OH, 1OMe)	Flavonol	6,8-Di-C-methylmyricetin 3,4'-dimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(2OH, 1OMe)	Flavonol	5-O-Methyloxyayanin-A
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Chrysosplenol G
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Chrysosplenol E
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	6,5'-Dihydroxy-3,7,2',4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Quercetagetin 3,5,6,3'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Quercetagetin 3,5,7,3'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Quercetagetin 3,5,7,4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Bonanzin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Chrysosplenetin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Casticin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Quercetagetin 3,7,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe, 1Methyl)-B(2OH)	Flavonol	8-C-Methylquercetagetin 3,6,7-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe, 1Methyl)-B(1OH, 1OMe)	Flavonol	8-C-Methylquercetagetin 3,6,3'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Chrysosplin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	5,5'-Dihydroxy-3,7,8,2'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Gossypetin 3,5,8,3'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Gossypetin 3,7,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Ternatin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Gossypetin 3,7,8,4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Gossypetin 3,8,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	5,4'-Dihydroxy-3,7,8,2'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH)	Flavonol	7,4'-Dihydroxy-3,5,6,8-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OMe)	Flavonol	5,8-Dihydroxy-3,6,7,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH)	Flavonol	Calycopterin
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OMe)	Flavonol	Araneosol
0.000	[Flavonol]-A(2OH, 2OMe)-B(1([@@]-Methylenedioxy))	Flavonol	Melinervin
0.000	[4-substituted Flavan (4-(4-Hydroxystyryl))]-A(1OMe)-B(1OH)	4-substituted Flavan	4'-Hydroxy-4-(4-hydroxystyryl)-7-methoxyflavan
0.000	[6-Hydroxyrotenone]-A(1OH, 1OMe)-B(2OMe)	6-Hydroxyrotenone	Dihydrostemonal