ピーク情報

シロイヌナズナ　地上部

pos

Peak #11764 MN MID: SE200_S1_M90

m/z: 513.35836, RT: 95.49, 強度: 187915, ログ強度: 1.65, アダクト: [M-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 5

DB検索結果: (9 names) Phyllofenone C;(+)-Phyllofenone C;Holstinone A;(-)-Holstinone A;Rubianol b;Cordianol F;(+)-Cordianol F;Acinospesigenin A;Guavanoic acid

DBごとのヒット数: ALL 6 KN 6

FlavonoidSearch最大スコア MS2: -, MS3: 0.200

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
C32H50O6	530.36074	1.705	Phyllofenone C	KNApSAcK: C00046855
C32H50O6	530.36074	1.705	(22E,24R)-25-hydroxy-3,3-dimethoxy-11alpha-acetoxyergosta-7,22-diene-6-one	LipidMAPS: LMST01031341
C32H50O6	530.36074	1.705	Holstinone A	KNApSAcK: C00039378
C32H50O6	530.36074	1.705	7beta-acetoxy-3beta,24S-dihydroxy-9beta,19-cyclolanost-25-en-28-oic acid	LipidMAPS: LMST01100056
C32H50O6	530.36074	1.705	Rubianol b	KNApSAcK: C00031235
C32H50O6	530.36074	1.705	Cordianol F	KNApSAcK: C00044654
C32H50O6	530.36074	1.705	Acinospesigenin A	KNApSAcK: C00044493 LipidMAPS: LMPR0106160001
C32H50O6	530.36074	1.705	Guavanoic acid	KNApSAcK: C00037224
C32H50O6	530.36074	1.705	7beta-acetoxy,3beta,25-dihydroxy-9beta,19-cyclo-lanost-23E-en-28-oic acid	LipidMAPS: LMST01100055

MSnスペクトル情報

Level: 2, プリカーサーm/z: 513.35840

Splash: splash10-05fr-0860900000-245701a93559f8b52a9c

m/z	Int.	NL	Rel.Int.
171.03	11315	342	1000
421.47	8658	92	765
207.19	8204	306	725
495.48	6160	18	544
189.09	3771	324	333
147.07	3338	366	295
439.41	3260	74	288
403.42	3210	110	283
457.45	2572	56	227
161.05	2215	352	195
197.08	2125	316	187
283.25	1879	230	166
281.18	1697	232	149
289.32	1531	224	135
225.05	1362	288	120
215.12	1337	298	118
459.57	1211	54	107
221.15	1125	292	99
307.21	1052	206	92
185.09	1045	328	92

Level: 3, プリカーサーm/z: 171.11044

Splash: splash10-004i-0900000000-2413b4432e11f293a4ad

m/z	Int.	NL	Rel.Int.
129.04	3253	42	1000
143.05	1044	28	320

Level: 3, プリカーサーm/z: 421.38000

Splash: splash10-0udi-0094800000-140af357fa73aa96cf19

m/z	Int.	NL	Rel.Int.
403.31	1942	18	1000
223.25	401	198	206
277.29	309	144	159
337.41	222	84	114
351.48	214	70	110
249.33	213	172	109
263.31	203	158	104
281.39	148	140	76
265.17	145	156	74
335.16	133	86	68
251.15	124	170	63
379.52	122	42	62
201.21	120	220	61
275.24	107	146	55
267.27	104	154	53
311.64	103	110	52
309.52	101	112	52
171.08	101	250	51
375.42	101	46	51
219.08	98	202	50

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.200	[Isoflavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Isoflavone	7-O-Methylisolupalbigenin
0.111	[Flavanone]-A(2OH)-B(2([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Sanggenol O
0.000	[Flavonol]-A(1OH, 3OMe)-B(1OH, 2OMe)	Flavonol	3-Demethyldigicitrin
0.000	[Flavanone]-A(1OH, 2(C-Prenyl))-B(1([@@]-Methylenedioxy))	Flavanone	Ovaliflavanone D
0.000	[Flavanone]-A(2OH)-B(1OMe, 1(C-Prenyl), 1(3-methylbutadienyl))	Flavanone	Burttinonedehydrate
0.000	[Flavone]-A(1([2,3:@@]-(8,8-Dimethyl-9-acetoxy-6-oxo-1,7-dioxaspiro[4,4]non-2-ene)))-B(none)	Flavone	Glabratephrin
0.000	[Flavone]-A(2OMe, 1(5-Methoxy-6-methyl-4-oxo-4H-pyran-3-yl))-B(none)	Flavone	5-O-Methylhoslundin
0.000	[Flavone]-A(2OMe, 1(5-Methoxy-6-methyl-4-oxo-4H-pyran-2-yl))-B(none)	Flavone	Oppositin
0.000	[Flavone]-A(1OMe, 1([2,3:@@]-(4-(2-Acetoxy-2-methylpropylidene)-5-oxofurano)))-B(none)	Flavone	Tephrorianin
0.000	[Flavone]-A(2OH)-B(1([2,3:@@]-(6,6-Dimethylpyrano)), 1(2-hydroxy-3-methyl-3-butenyl))	Flavone	Yinyanghuo A
0.000	[3-substituted Flavone (3-C-Prenyl)]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	3-substituted Flavone	Morusin
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(2OH)	Flavone	Brosimone G
0.000	[3-substituted Flavone (3-C-Prenyl)]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	3-substituted Flavone	Kuwanon B
0.000	[3-substituted Flavone (3-C-Prenyl)]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	3-substituted Flavone	Kuwanon A
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(2OH)	Flavone	Australone A
0.000	[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 1(3-Methyl-1-butenyl))-B(1OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Brosimone I
0.000	[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 1(C-Prenyl))-B(1OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Cyclomulberrin
0.000	[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 1(C-Prenyl))-B(1OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Isocyclomulberrin
0.000	[Flavonol]-A(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Flavonol	Macaflavone I
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(2OH, 1OMe)	Flavonol	5,3',5'-Trihydroxy-3,6,7,8,4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH, 2OMe)	Flavonol	5,7,4'-Trihydroxy-3,6,8,3',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH, 2OMe)	Flavonol	5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(2OH, 1OMe)	Flavonol	5,4',5'-Trihydroxy-3,6,7,8,2'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH, 2OMe)	Flavonol	5,7,4'-Trihydroxy-3,6,8,2',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH, 2OMe)	Flavonol	5,7,2'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone
0.000	[Flavan 3-ol]-A(1OMe, 1([7,8:@@]-(5,6-Dihydro-2-hydroxynaphthaleno)))-B(1OH, 1OMe)	Flavan 3-ol	Shanciol
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Ulexone C
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Ulexin D
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	Isoflavone	Euchrenone b8
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	Isoflavone	Euchrenone b9
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavone	Pomiferin
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavone	Auriculasin
0.000	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Gancaonin H
0.000	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Angustone B
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1(C-Prenyl))	Isoflavone	Angustone C
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavone	Auriculatin
0.000	[Isoflavan]-A(1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH, 1([@@]-Methylenedioxy))	Isoflavan	Nitidulan
0.000	[Pterocarpan]-A(1OH, 1Geranyl)-B(1([@@]-Methylenedioxy))	Pterocarpan	Nitiducol
0.000	[Pterocarpan]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	Pterocarpan	Gangetin
0.000	[Coumaranochromon]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Coumaranochromon	Lupinalbin F
0.000	[alpha-Phenylcoumarinic acid]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1([2,3:@@]-(5,6-Dimethyl-4-oxodihydropyrano)))-B(none)	alpha-Phenylcoumarinic acid	Calophyllic acid

ピーク情報

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MSnスペクトル情報

FlavonoidSearch結果

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