ピーク情報
|
ポプラ, 幼植物, 地上部
pos
|
| Peak #8682 MN MID: SE205_S08_M90 |
| m/z: 403.15419, RT: 85.18, 強度: 4630, ログ強度: 0.07, 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: (6 names) Ulexin B;Ulexone B;Inophyllum C;Tomentolide A;Ormosidin;7,4'-Dihydroxy-6'',6''-dimethylpyrano[2'',3'':5,6]-8-(3-methyl-1,3-butadienyl)isoflavone |
| DBごとのヒット数: ALL 5 KN 5 |
| FlavonoidSearch最大スコア MS2: -, 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 |
|---|---|---|---|---|
| C25H22O5 | 402.14672 | 0.467 | Ulexin B | KNApSAcK: C00019080 |
| C25H22O5 | 402.14672 | 0.467 | Ulexone B | FlavonoidViewer: FLIAAANP0012 KNApSAcK: C00009937 LipidMAPS: LMPK12050212 |
| C25H22O5 | 402.14672 | 0.467 | Tomentolide A | FlavonoidViewer: FLNAA9NP0005 KNApSAcK: C00010216 LipidMAPS: LMPK12100026 |
| C25H22O5 | 402.14672 | 0.467 | Inophyllum C | FlavonoidViewer: FLNAA9NP0002 KNApSAcK: C00010213, C00035840 LipidMAPS: LMPK12100023 |
| C25H22O5 | 402.14672 | 0.467 | Ormosidin | KNApSAcK: C00019538 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 403.15387 |
| Splash: splash10-001i-0090000000-a3232d56575d0e42c225 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 283.06 | 13949 | 120 | 1000 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano))) | Isoflavone | Ulexone B |
| 0.000 | [Flavone]-A(2OMe)-B(4OMe) | Flavone | 5,6,2',3',5',6'-Hexamethoxyflavone |
| 0.000 | [Flavone]-A(3OMe)-B(3OMe) | Flavone | 5,6,8,3',4',5'-Hexamethoxyflavone |
| 0.000 | [Flavone]-A(2OMe)-B(4OMe) | Flavone | 5,6,2',3',4',6'-Hexamethoxyflavone |
| 0.000 | [Flavone]-A(3OMe)-B(3OMe) | Flavone | 5,6,7,3',4',5'-Hexamethoxyflavone |
| 0.000 | [Flavone]-A(3OMe)-B(3OMe) | Flavone | Bannamurpanisin |
| 0.000 | [Flavone]-A(4OMe)-B(2OMe) | Flavone | Nobiletin |
| 0.000 | [Dihydroflavonol]-A(2OH, 1OMe, 1(C-Prenyl))-B(2OH) | Dihydroflavonol | Paraibanol |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(1OH) | 2'-Hydroxychalcone | 8-p-Coumaroyl-3,4-dihydro-5,7-dihydroxy-4-phenylcoumarin |
| 0.000 | [CCS-type derivative / [beta,2]-(4-(1'-Hydroxy-1'-methylethyl))ethanodihydrochalcone]-A(3OH)-B(2OMe) | CCS-type derivative / [beta,2]-(4-(1'-Hydroxy-1'-methylethyl))ethanodihydrochalcone | Antiarone K |
| 0.000 | [Flavanone]-A(1OH, 1([2,3:@@]-(4-(p-Hydroxyphenyl)-6-oxodihydropyrano)))-B(none) | Flavanone | Calomelanol I |
| 0.000 | [Flavanone]-A(1OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(1OH) | Flavanone | Calomelanol H |
| 0.000 | [Flavone]-A(2OH, 1(C-Xylosyl))-B(1OH) | Flavone | Cerarvensin |
| 0.000 | [Flavone]-A(2OH, 1(C-Arabinosyl))-B(1OH) | Flavone | Isomollupentin |
| 0.000 | [Flavone]-A(2OH, 1(C-Arabinosyl))-B(1OH) | Flavone | Mollupentin |
| 0.000 | [Flavone]-A(1OH, 3OMe)-B(1OMe, 1([@@]-Methylenedioxy)) | Flavone | 7-Hydroxy-5,6,8,3'-tetramethoxy-4',5'-methylenedioxyflavone |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(none)-C(1(O-Cinnamoyl)) | Dihydroflavonol | Pinobanksin 3-O-cinnamate |
| 0.000 | [Flavonol (3-OMe)]-A(2OMe)-B(3OMe) | Flavonol | Myricetin hexamethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OMe)-B(3OMe) | Flavonol | 3,5,7,2',4',5'-Hexamethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(3OMe)-B(2OMe) | Flavonol | Quercetagetin hexamethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OMe)-B(2OMe) | Flavonol | Gossypetin hexamethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(4OMe)-B(1OMe) | Flavonol | 3,5,6,7,8,4'-Hexamethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1([@@]-Methylenedioxy)) | Flavonol | 5-Demethylmelibentin |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1([@@]-Methylenedioxy)) | Flavonol | 2-(1,3-Benzodioxol-5-yl)-7-hydroxy-3,5,6,8-tetramethoxy-4H-1-benzopyran-4-one |
| 0.000 | [Pterocarpan-6a-ol]-A(1OH)-B(2OMe, 1(3-hydroxy-3-methylbutyl)) | Pterocarpan-6a-ol | Sphenostylin D |
| 0.000 | [4-phenylcoumarin]-A(1([2,3:@@]-(6,6-Dimethylpyrano)), 1([2,3:@@]-(5,6-Dimethyl-4-oxodihydropyrano)))-B(none) | 4-phenylcoumarin | Inophyllum E |
| 0.000 | [4-phenylcoumarin]-A(1([2,3:@@]-(6,6-Dimethylpyrano)), 1([2,3:@@]-(5,6-Dimethyl-4-oxodihydropyrano)))-B(none) | 4-phenylcoumarin | Tomentolide A |
| Level: 3, プリカーサーm/z: 283.06091 |
| Splash: splash10-004i-0900000000-040b8526493b9d679a76 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 178.93 | 11645 | 104 | 1000 |
| 241.05 | 1190 | 42 | 102 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Flavone]-A(2OMe)-B(none) | Flavone | 7,8-Dimethoxyflavone |
| 0.000 | [Flavone]-A(2OMe)-B(none) | Flavone | 5,6-Dimethoxyflavone |
| 0.000 | [Flavone]-A(1OMe)-B(1OMe) | Flavone | 6,3'-Dimethoxyflavone |
| 0.000 | [Flavone]-A(2OMe)-B(none) | Flavone | chrysin 5,7-dimethyl ether |
| 0.000 | [Isoflavone]-A(1OMe)-B(1OMe) | Isoflavone | 7,4'-Di-O-methyldaidzein |
| 0.000 | [Isoflavone]-A(2OMe)-B(none) | Isoflavone | 5,7-Dimethoxyisoflavone |
| 0.000 | [Coumestan]-A(1OH)-B(1OMe) | Coumestan | 9-O-Methylcoumestrol |
| 0.000 | [Aurone]-A(1OH, 1([@@]-Methylenedioxy))-B(none) | Aurone | 4,5-Methylenedioxy-6-hydroxyaurone |
| 0.000 | [UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Chalcone]-A(1OH, 3Methyl)-B(none) | UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Chalcone | Ohobanin |
| 0.000 | [UBR-type derivative / 2'-Oxo-3'-enyl-0-hydroxy-type Chalcone]-A(1([2,3:@@]-(5-Oxotetrahydrofurano)))-B(none) | UBR-type derivative / 2'-Oxo-3'-enyl-0-hydroxy-type Chalcone | Cryptocaryone |
| 0.000 | [Dihydrochalcone alpha-ol]-A(1OH, 1([2,3:@@]-Furano))-B(none) | Dihydrochalcone alpha-ol | Castillene E |
| 0.000 | [Flavone]-A(1OH, 1Methyl)-B(1OMe) | Flavone | Saltillin |
| 0.000 | [Flavone]-A(1OH, 1OMe, 1Methyl)-B(none) | Flavone | 6-Methyltectochrysin |
| 0.000 | [Flavone]-A(2OH, 2Methyl)-B(none) | Flavone | Matteuorien |
| 0.000 | [Flavonol (3-OMe)]-A(1OMe)-B(none) | Flavonol | 3,7-Dimethoxyflavone |
| 0.000 | [Isoflavone]-A(1OH)-B(1OH, 1Formyl) | Isoflavone | Corylinal |
| 0.000 | [Isoflavone]-A(1OH)-B(1([@@]-Methylenedioxy)) | Isoflavone | Pseudobaptigenin |
| 0.000 | [Pterocarpene]-A(1OMe)-B(1OMe) | Pterocarpene | Anhydrovariabilin |
| 0.000 | [Pterocarpene]-A(1OH)-B(1([@@]-Methylenedioxy)) | Pterocarpene | 3-Hydroxy-8,9-methylenedioxypterocarp-6a-ene |
| 0.000 | [Coumestan]-A(1Methyl)-B(2OH) | Coumestan | 8,9-Dihydroxy-1-methylcoumestan |
| 0.000 | [4-phenylcoumarin]-A(2OMe)-B(none) | 4-phenylcoumarin | Methyldalbergin |