| SpectraBase Compound ID | Fi20zhxpI2A |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-12-6-7-16-19(2,3)8-5-9-20(16,4)14(12)11-15(21)13-10-17(22)24-18(13)23/h6,10,14-16,18,21,23H,5,7-9,11H2,1-4H3/t14-,15+,16-,18?,20+/m0/s1 |
| InChIKey | YKNBAYWGOSCBRV-UTVKXTEFSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 81zpuso2YKz |
|---|---|
| Name | (12R,16.xi.)-12,16-Dihydroxylabda-7,13-dien-15,16-olide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O4 |
| InChI | InChI=1S/C20H30O4/c1-12-6-7-16-19(2,3)8-5-9-20(16,4)14(12)11-15(21)13-10-17(22)24-18(13)23/h6,10,14-16,18,21,23H,5,7-9,11H2,1-4H3/t14-,15+,16-,18?,20+/m0/s1 |
| InChIKey | YKNBAYWGOSCBRV-UTVKXTEFSA-N |
| Instrument Name | Hewlett-Packard HP 5989A |
| Ionization Type | EI positive ion |
| Literature Reference DOI | 10.1021/np010590u |
| Molecular Weight | 334.456 g/mol |
| SMILES | OC1C([C@@](C[C@]2(C(=CC[C@]3(C(CCC[C@]23C)(C)C)[H])C)[H])(O)[H])=CC(O1)=O |
| SPLASH | splash10-0a4i-9800000000-03c5f01d96f4b927fb6b |
| Source of Spectrum | G4-65-666-4 |
| Wiley ID | 1883656 |