| SpectraBase Compound ID | 3s8Hx74YBh5 |
|---|---|
| InChI | InChI=1S/C22H36O4/c1-15(11-14-26-17(3)23)7-9-18-16(2)8-10-19-21(18,4)12-6-13-22(19,5)20(24)25/h15,18-19H,2,6-14H2,1,3-5H3,(H,24,25)/t15-,18+,19+,21+,22-/m0/s1 |
| InChIKey | AAPGEKMDLXBUBL-KVQUSVNISA-N |
| Mol Weight | 364.5 g/mol |
| Molecular Formula | C22H36O4 |
| Exact Mass | 364.26136 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KPkTev820GY |
|---|---|
| Name | (13S)-15-Acetoxylabd-8(17)-en-19-oic acid |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H36O4 |
| InChI | InChI=1S/C22H36O4/c1-15(11-14-26-17(3)23)7-9-18-16(2)8-10-19-21(18,4)12-6-13-22(19,5)20(24)25/h15,18-19H,2,6-14H2,1,3-5H3,(H,24,25)/t15-,18+,19+,21+,22-/m0/s1 |
| InChIKey | AAPGEKMDLXBUBL-KVQUSVNISA-N |
| Molecular Weight | 364.526 g/mol |
| SMILES | OC([C@@]1([C@]2([C@@]([C@@](C(CC2)=C)(CC[C@@](CCOC(=O)C)(C)[H])[H])(CCC1)C)[H])C)=O |
| SPLASH | splash10-01bi-0927000000-68b9cf679f24bd740d98 |
| Source of Spectrum | E1-44-1243-1 |
| Wiley ID | 1553494 |