![METHYL-12-[2-(2-HYDROXY-6-METHOXYBENZOYL)-VINYL]-DEHYDROABIETATE](/api/spectrum/Jz7F8iviO3q/structure.png?h=300&w=458 "METHYL-12-[2-(2-HYDROXY-6-METHOXYBENZOYL)-VINYL]-DEHYDROABIETATE")
| SpectraBase Compound ID | 36Oq8bTFMFG |
|---|---|
| InChI | InChI=1S/C31H38O5/c1-19(2)22-17-21-12-14-27-30(3,15-8-16-31(27,4)29(34)36-6)23(21)18-20(22)11-13-25(33)28-24(32)9-7-10-26(28)35-5/h7,9-11,13,17-19,27,32H,8,12,14-16H2,1-6H3/b13-11+/t27-,30-,31-/m1/s1 |
| InChIKey | PWBLPLPKFANBIF-IXBCBBMCSA-N |
| Mol Weight | 490.6 g/mol |
| Molecular Formula | C31H38O5 |
| Exact Mass | 490.271924 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jz7F8iviO3q |
|---|---|
| Name | METHYL-12-[2-(2-HYDROXY-6-METHOXYBENZOYL)-VINYL]-DEHYDROABIETATE |
| Compound Number | 4B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H38O5 |
| InChI | InChI=1S/C31H38O5/c1-19(2)22-17-21-12-14-27-30(3,15-8-16-31(27,4)29(34)36-6)23(21)18-20(22)11-13-25(33)28-24(32)9-7-10-26(28)35-5/h7,9-11,13,17-19,27,32H,8,12,14-16H2,1-6H3/b13-11+/t27-,30-,31-/m1/s1 |
| InChIKey | PWBLPLPKFANBIF-IXBCBBMCSA-N |
| Literature Reference Author | S.M.C.S.MONTEIRO,A.J.D.SILVESTRE,A.M.S.SILVA,J.A.S.CAVALEIRO |
| Literature Reference Citation | MH.CHEM.,139,1119(2008) |
| Literature Reference DOI | 10.1007/s00706-008-0889-1 |
| Molecular Weight | 490.640 g/mol |
| Sample ID | 40069 |
| Solvent | CDCl3 |