![5-HEPTENOIC ACID, 2-[2-(2,3,3A,4,5,7A-HEXAHYDRO-3,6-DIMETHYL-2-BENZOFURANYL)ETHYLIDENE]-6-METHYL-METHYL ESTER](/api/spectrum/O1S24uIjzN/structure.png?h=300&w=458 "5-HEPTENOIC ACID, 2-[2-(2,3,3A,4,5,7A-HEXAHYDRO-3,6-DIMETHYL-2-BENZOFURANYL)ETHYLIDENE]-6-METHYL-METHYL ESTER")
| SpectraBase Compound ID | DangCahoTe5 |
|---|---|
| InChI | InChI=1S/C21H32O3/c1-14(2)7-6-8-17(21(22)23-5)10-12-19-16(4)18-11-9-15(3)13-20(18)24-19/h7,10,13,16,18-20H,6,8-9,11-12H2,1-5H3/b17-10+ |
| InChIKey | PACASBDEISTIRK-LICLKQGHSA-N |
| Mol Weight | 332.5 g/mol |
| Molecular Formula | C21H32O3 |
| Exact Mass | 332.235145 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | O1S24uIjzN |
|---|---|
| Name | 5-HEPTENOIC ACID, 2-[2-(2,3,3A,4,5,7A-HEXAHYDRO-3,6-DIMETHYL-2-BENZOFURANYL)ETHYLIDENE]-6-METHYL-METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C21H32O3 |
| InChI | InChI=1S/C21H32O3/c1-14(2)7-6-8-17(21(22)23-5)10-12-19-16(4)18-11-9-15(3)13-20(18)24-19/h7,10,13,16,18-20H,6,8-9,11-12H2,1-5H3/b17-10+ |
| InChIKey | PACASBDEISTIRK-LICLKQGHSA-N |
| NMR Standard | TMS |
| Solvent | CDCL3 |