| SpectraBase Compound ID | FL9jTFguqeU |
|---|---|
| InChI | InChI=1S/C21H24O5/c1-5-8-21(12-19(24-4)17(23-3)11-20(21)22)14(2)9-15-6-7-16-18(10-15)26-13-25-16/h5-7,10-12,14H,1,8-9,13H2,2-4H3 |
| InChIKey | HPQGCXZCNINQHZ-UHFFFAOYSA-N |
| Mol Weight | 356.42 g/mol |
| Molecular Formula | C21H24O5 |
| Exact Mass | 356.162374 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G6R9TIntxx1 |
|---|---|
| Name | 4',5'-Dimethoxy-3,4-methylenedioxy-2'-oxo-.delta.(3',5',8'-8,1'-lignan[6-[2-(1,3-benzodioxol-5-yl)-1-methylethyl-3,4-dimethoxy-6-(2-propenyl)-2,4-cyclohexadien-1-one) |
| Alternate Name(s) | Iso-4',5'-dimethoxy-3,4-methylenedioxy-2'-oxo-.delta.(3',5',8'-8,1'-lignan[iso-6-[2-(1,3-benzodioxol-5-yl)-1-methylethyl-3,4-dimethoxy-6-(2-propenyl)-2,4-cyclohexadien-1-one) rel-(7S,8S,7'S,8'S)-3',4'-Dimethoxy-3,4-methylenedioxy-8,8',7,O,7'-liganan [(2S,3S,4S,5S)-(3,4-dimethoxyphenyl)-3,4-dimethyl-2-tetrahydrofurananyl]-1,3-benzodioxol] 6-[1-(1,3-benzodioxol-5-yl)propan-2-yl]-3,4-dimethoxy-6-prop-2-enyl-1-cyclohexa-2,4-dienone 6-[1-(1,3-benzodioxol-5-yl)propan-2-yl]-3,4-dimethoxy-6-prop-2-enylcyclohexa-2,4-dien-1-one 6-[1-(1,3-benzodioxol-5-yl)propan-2-yl]-3,4-dimethoxy-6-prop-2-enyl-cyclohexa-2,4-dien-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H24O5 |
| InChI | InChI=1S/C21H24O5/c1-5-8-21(12-19(24-4)17(23-3)11-20(21)22)14(2)9-15-6-7-16-18(10-15)26-13-25-16/h5-7,10-12,14H,1,8-9,13H2,2-4H3 |
| InChIKey | HPQGCXZCNINQHZ-UHFFFAOYSA-N |
| Molecular Weight | 356.418 g/mol |
| SMILES | C1(C=C(OC)C(=CC1=O)OC)(C(Cc1cc2OCOc2cc1)C)CC=C |
| SPLASH | splash10-000f-9501000000-fa59d579ff24db160a39 |
| Source of Spectrum | F-50-10584-2 |
| Wiley ID | 789127 |