| SpectraBase Compound ID | DZAx8diDF9f |
|---|---|
| InChI | InChI=1S/C17H28O3/c1-11-6-7-15(20-12(2)18)17(5)9-8-13(10-14(11)17)16(3,4)19/h10-11,13,15,19H,6-9H2,1-5H3 |
| InChIKey | FFSJEOMHGZXRSD-UHFFFAOYSA-N |
| Mol Weight | 280.41 g/mol |
| Molecular Formula | C17H28O3 |
| Exact Mass | 280.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B7ha7P9krpQ |
|---|---|
| Name | 6-(2-Hydroxypropan-2-yl)-4,8A-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol, 1-acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.203844759 u |
| Formula | C17H28O3 |
| InChI | InChI=1S/C17H28O3/c1-11-6-7-15(20-12(2)18)17(5)9-8-13(10-14(11)17)16(3,4)19/h10-11,13,15,19H,6-9H2,1-5H3 |
| InChIKey | FFSJEOMHGZXRSD-UHFFFAOYSA-N |
| SMILES | C1(CCC(C=2C1(C)CCC(C2)C(O)(C)C)C)OC(C)=O |