![METHYL-12-[2-(2-HYDROXYBENZOYL)-VINYL]-DEHYDROABIETATE](/api/spectrum/E6r73gzhWcX/structure.png?h=300&w=458 "METHYL-12-[2-(2-HYDROXYBENZOYL)-VINYL]-DEHYDROABIETATE")
| SpectraBase Compound ID | IRjbuAgmmUc |
|---|---|
| InChI | InChI=1S/C30H36O4/c1-19(2)23-17-21-12-14-27-29(3,15-8-16-30(27,4)28(33)34-5)24(21)18-20(23)11-13-26(32)22-9-6-7-10-25(22)31/h6-7,9-11,13,17-19,27,31H,8,12,14-16H2,1-5H3/b13-11+/t27-,29-,30-/m1/s1 |
| InChIKey | RGPBPBHLFYULKP-VGCKPCQISA-N |
| Mol Weight | 460.6 g/mol |
| Molecular Formula | C30H36O4 |
| Exact Mass | 460.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E6r73gzhWcX |
|---|---|
| Name | METHYL-12-[2-(2-HYDROXYBENZOYL)-VINYL]-DEHYDROABIETATE |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H36O4 |
| InChI | InChI=1S/C30H36O4/c1-19(2)23-17-21-12-14-27-29(3,15-8-16-30(27,4)28(33)34-5)24(21)18-20(23)11-13-26(32)22-9-6-7-10-25(22)31/h6-7,9-11,13,17-19,27,31H,8,12,14-16H2,1-5H3/b13-11+/t27-,29-,30-/m1/s1 |
| InChIKey | RGPBPBHLFYULKP-VGCKPCQISA-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 | 460.613 g/mol |
| Sample ID | 40068 |
| Solvent | CDCl3 |