| SpectraBase Compound ID | IhjAoZYVmk5 |
|---|---|
| InChI | InChI=1S/C20H28O4/c1-12(11-21)13-5-6-15-14(9-13)16(22)10-17-19(15,2)7-4-8-20(17,3)18(23)24/h5-6,9,12,16-17,21-22H,4,7-8,10-11H2,1-3H3,(H,23,24)/t12?,16-,17+,19+,20+/m0/s1 |
| InChIKey | BETVGAOCAIJQOL-QQJWSKILSA-N |
| Mol Weight | 332.44 g/mol |
| Molecular Formula | C20H28O4 |
| Exact Mass | 332.198759 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B9ak4KLWGiU |
|---|---|
| Name | 7.beta., 16-Dihydroxy-dehydroabietic Acid |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H28O4 |
| InChI | InChI=1S/C20H28O4/c1-12(11-21)13-5-6-15-14(9-13)16(22)10-17-19(15,2)7-4-8-20(17,3)18(23)24/h5-6,9,12,16-17,21-22H,4,7-8,10-11H2,1-3H3,(H,23,24)/t12?,16-,17+,19+,20+/m0/s1 |
| InChIKey | BETVGAOCAIJQOL-QQJWSKILSA-N |
| Molecular Weight | 332.440 g/mol |
| SMILES | OCC(c1cc2c([C@@]3([C@@](C[C@@]2(O)[H])([C@@](CCC3)(C(=O)O)C)[H])C)cc1)C |
| SPLASH | splash10-0f89-0298000000-0996fef9274ffe4d9a5f |
| Source of Spectrum | G4-70-158-6 |
| Wiley ID | 1694905 |