ピーク情報
|
（かんきつ類） ゆず 果皮 生
pos
|
| Peak #7905 MN MID: SE123_S071421_M90 |
| m/z: 347.11240, RT: 69.29, 強度: 22379, ログ強度: 0.78, 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: (27 names) 5,6-Dihydroxy-7,8,4'-trimethoxyflavanone;5,3'-Dihydroxy-7,8,4'-trimethoxyflavanone;Laurentiquinone;3',6'-Diketo-7-hydroxy-8,2',4'-trimethoxyisoflavan;Hamiltone B;5,4'-Dihydroxy-6,7,8-trimethoxyflavano... |
| DBごとのヒット数: ALL 23 KG 1 KN 21 HM 1 |
| FlavonoidSearch最大スコア MS2: 0.182, MS3: - |
DB検索結果
ppm
| 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 |
|---|---|---|---|---|
| C18H18O7 | 346.10525 | -0.380 | 5,6-Dihydroxy-7,8,4'-trimethoxyflavanone | FlavonoidViewer: FL2FGANS0001 KNApSAcK: C00008256 LipidMAPS: LMPK12140683 |
| C18H18O7 | 346.10525 | -0.380 | 5,3'-Dihydroxy-7,8,4'-trimethoxyflavanone | FlavonoidViewer: FL2FFCNS0002 KNApSAcK: C00008308 LipidMAPS: LMPK12140673 |
| C18H18O7 | 346.10525 | -0.380 | Laurentiquinone | KNApSAcK: C00018908 |
| C18H18O7 | 346.10525 | -0.380 | Hamiltone B | KNApSAcK: C00049877 |
| C18H18O7 | 346.10525 | -0.380 | 5,4'-Dihydroxy-6,7,8-trimethoxyflavanone | FlavonoidViewer: FL2FGANS0002 KNApSAcK: C00008257 LipidMAPS: LMPK12140684 |
| C18H18O7 | 346.10525 | -0.380 | Amorphaquinone | FlavonoidViewer: FLICQUNS0005 KNApSAcK: C00009744 LipidMAPS: LMPK12080054 |
| C18H18O7 | 346.10525 | -0.380 | Brandisianin F | KNApSAcK: C00038635 |
| C18H18O7 | 346.10525 | -0.380 | Hamilcone | FlavonoidViewer: FL1CECNS0003 KNApSAcK: C00014434 LipidMAPS: LMPK12120349 |
| C18H18O7 | 346.10525 | -0.380 | Muscomin | HMDB: HMDB0037250 |
| C18H18O7 | 346.10525 | -0.380 | 5,2'-Dihydroxy-6,7,6'-trimethoxyflavanone | FlavonoidViewer: FL2FE8NS0003 KNApSAcK: C00008340 LipidMAPS: LMPK12140601 |
| C18H18O7 | 346.10525 | -0.380 | (6R)-2-Acetyl-6-(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)-3-hydroxy-6-methyl-2,4-cyclohexadien-1-one | KEGG: C15591 |
| C18H18O7 | 346.10525 | -0.380 | (R)-5,7-Dihydroxy-2',4',5'-trimethoxyisoflavanone | KNApSAcK: C00018977 |
| C18H18O7 | 346.10525 | -0.380 | Inumakilactone B | KNApSAcK: C00000281 |
| C18H18O7 | 346.10525 | -0.380 | 2',6'-Dihydroxy-4,3'-dimethoxy-4',5'-methylenedioxydihydrochalcone | FlavonoidViewer: FL1DGANS0001 KNApSAcK: C00007956 LipidMAPS: LMPK12120565 |
| C18H18O7 | 346.10525 | -0.380 | 5,2'-Dihydroxy-7,8,6'-trimethoxyflavanone | FlavonoidViewer: FL2FF8NS0003 KNApSAcK: C00008341 LipidMAPS: LMPK12140645 |
| C18H18O7 | 346.10525 | -0.380 | 5,2'-Dihydroxy-7,4',5'-trimethoxyflavanone | FlavonoidViewer: FL2FALNS0007 KNApSAcK: C00014134 LipidMAPS: LMPK12140536 |
| C18H18O7 | 346.10525 | -0.380 | Kushecarpin B | KNApSAcK: C00019179 |
| C18H18O7 | 346.10525 | -0.380 | Nigrolineaxanthone U | KNApSAcK: C00042771 |
| C18H18O7 | 346.10525 | -0.380 | 5,3'-Dihydroxy-6,7,4'-trimethoxyflavanone | FlavonoidViewer: FL2FECNS0001 KNApSAcK: C00008307 LipidMAPS: LMPK12140626 |
| C18H18O7 | 346.10525 | -0.380 | Angulifolin A | KNApSAcK: C00041341, C00041342 |
| C18H18O7 | 346.10525 | -0.380 | Agestricin D | FlavonoidViewer: FL2FECNS0002 KNApSAcK: C00008309 LipidMAPS: LMPK12140627 |
| C18H18O7 | 346.10525 | -0.380 | 2,8-Dihydroxy-3,9,10-trimethoxypterocarpan | FlavonoidViewer: FLID2GNS0001 KNApSAcK: C00009634 LipidMAPS: LMPK12070070 |
| C18H18O7 | 346.10525 | -0.380 | 1,2-seco-trypacidin | KNApSAcK: C00052517 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 347.11185 |
| Splash: splash10-0002-0900000000-643caf628f7bcbd5944a |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 197.00 | 201426 | 150 | 1000 |
| 176.98 | 35971 | 170 | 178 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.182 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,2'-Dihydroxy-6,7,6'-trimethoxyflavanone |
| 0.182 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,3'-Dihydroxy-6,7,4'-trimethoxyflavanone |
| 0.182 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | Agestricin D |
| 0.182 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,2'-Dihydroxy-7,8,6'-trimethoxyflavanone |
| 0.182 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,3'-Dihydroxy-7,8,4'-trimethoxyflavanone |
| 0.143 | [Pterocarpan]-A(1OH, 1OMe)-B(1OH, 2OMe) | Pterocarpan | 2,8-Dihydroxy-3,9,10-trimethoxypterocarpan |
| 0.059 | [Flavonol]-A(1OH, 2OMe)-B(2OH) | Flavonol | Eupatolitin |
| 0.059 | [Flavonol]-A(1OH, 2OMe)-B(2OH) | Flavonol | Zanthoxyl flavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,3',4'-Tetrahydroxy-6,5'-dimethoxyflavone |
| 0.000 | [Flavone]-A(1OH, 2OMe)-B(3OH) | Flavone | 5,3',4',5'-Tetrahydroxy-6,7-dimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,2',4'-Tetrahydroxy-6,5'-dimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | Ganhuangenin |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,2',3'-Tetrahydroxy-8,6'-dimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,3',5'-Tetrahydroxy-8,4'-dimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,2',4'-Tetrahydroxy-8,5'-dimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | 5,6,2',6'-Tetrahydroxy-7,8-dimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | Leucanthogenin |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | 5,7,3',4'-Tetrahydroxy-6,8-dimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | 5,6,3',4'-Tetrahydroxy-7,8-dimethoxyflavone |
| 0.000 | [Flavanone]-A(1OH, 3OMe)-B(1OH) | Flavanone | 5,4'-Dihydroxy-6,7,8-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 2OMe) | Flavanone | 5,2'-Dihydroxy-7,4',5'-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(2OH, 2OMe)-B(1OMe) | Flavanone | 5,6-Dihydroxy-7,8,4'-trimethoxyflavanone |
| 0.000 | [Dihydrochalcone]-A(1OH, 4OMe)-B(none) | Dihydrochalcone | Dihydrokanakugiol |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 3OMe)-B(2OH) | 2'-Hydroxychalcone | Hamilcone |
| 0.000 | [Flavonol]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Inucrithmin |
| 0.000 | [Flavonol]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Myricetin 7,4'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH)-B(1OH, 2OMe) | Flavonol | Myricetin 3',4'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH)-B(1OH, 2OMe) | Flavonol | Syringetin |
| 0.000 | [Flavonol]-A(2OH)-B(1OH, 2OMe) | Flavonol | Viscidulin III |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Spinacetin |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Laciniatin |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Quercetagetin 7,3'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 3',8-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 7,4'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Limocitrin |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 8,4'-dimethyl ether |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe, 1([@@]-Methylenedioxy))-B(1OMe) | Dihydrochalcone | 2',6'-Dihydroxy-4,3'-dimethoxy-4',5'-methylenedioxydihydrochalcone |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(2OH)-C(1(O-Acetyl)) | Dihydroflavonol | Taxifolin 3-O-acetate |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | Myricetin 3,4'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | Artemexitin |
| 0.000 | [Flavonol]-A(2OH, 1Methyl)-B(2OH, 1OMe) | Flavonol | Dumosol |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1Methyl)-B(3OH) | Flavonol | Alluaudiol |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | 5,7,4',5'-Tetrahydroxy-3,2'-dimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | 5,7,2',5'-Tetrahydroxy-3,4'-dimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Quercetagetin 3,3'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Quercetagetin 3,4'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Axillarin |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Tomentin |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Gossypetin 3,3'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Gossypetin 3,4'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | 7,8,3',4'-Trihydroxy-3,5-dimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Gossypetin 3,7-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Gossypetin 3,8-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OH, 1OMe)-B(1OH) | Flavonol | 5,7,8,4'-Tetrahydroxy-3,6-dimethoxyflavone |
| 0.000 | [Flavan 3,4-diol]-A(1OH, 1OMe, 2Methyl)-B(1OMe) | Flavan 3,4-diol | 3,4,7-Trihydroxy-5,4'-dimethoxy-6,8-dimethylflavan |
| 0.000 | [UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan]-A(1OH, 1OMe)-B(2OMe) | UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan | Amorphaquinone |
| Level: 3, プリカーサーm/z: 196.99579 |
| Splash: splash10-001i-0900000000-bb355e7461e6b26f25a8 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 182.01 | 53705 | 15 | 1000 |
| 163.91 | 7343 | 33 | 136 |
| 165.06 | 3435 | 32 | 63 |
FlavonoidSearch結果
ヒットなし