![Methyl 14-[2'-(2"-hydroxy-6''-methoxybenzoyl)vinyl]-dehydroabietate](/api/spectrum/DPdXCxmbvgo/structure.png?h=300&w=458 "Methyl 14-[2'-(2\"-hydroxy-6''-methoxybenzoyl)vinyl]-dehydroabietate")
| SpectraBase Compound ID | F3AqS1JrM3y |
|---|---|
| InChI | InChI=1S/C31H38O5/c1-19(2)20-11-14-23-22(13-16-27-30(23,3)17-8-18-31(27,4)29(34)36-6)21(20)12-15-25(33)28-24(32)9-7-10-26(28)35-5/h7,9-12,14-15,19,27,32H,8,13,16-18H2,1-6H3/b15-12+/t27?,30-,31-/m1/s1 |
| InChIKey | SVTGIHVWWYUASF-GDLKHXCESA-N |
| Mol Weight | 490.6 g/mol |
| Molecular Formula | C31H38O5 |
| Exact Mass | 490.271924 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DPdXCxmbvgo |
|---|---|
| Name | Methyl 14-[2'-(2"-hydroxy-6''-methoxybenzoyl)vinyl]-dehydroabietate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H38O5 |
| InChI | InChI=1S/C31H38O5/c1-19(2)20-11-14-23-22(13-16-27-30(23,3)17-8-18-31(27,4)29(34)36-6)21(20)12-15-25(33)28-24(32)9-7-10-26(28)35-5/h7,9-12,14-15,19,27,32H,8,13,16-18H2,1-6H3/b15-12+/t27?,30-,31-/m1/s1 |
| InChIKey | SVTGIHVWWYUASF-GDLKHXCESA-N |
| Molecular Weight | 490.640 g/mol |
| SMILES | Oc1c(C(\C=C\c2c3c([C@@]4(C([C@@](C(=O)OC)(C)CCC4)CC3)C)ccc2C(C)C)=O)c(OC)ccc1 |
| SPLASH | splash10-0uka-0602900000-293c045ae24cc66956d3 |
| Source of Spectrum | AH-139-1124-6b |
| Wiley ID | 1695837 |