| SpectraBase Compound ID | CRqA6sSFLgN |
|---|---|
| InChI | InChI=1S/C15H24O2/c1-13(2)8-12(17)15-7-5-11(16)14(3,9-15)6-4-10(13)15/h10,12,17H,4-9H2,1-3H3/t10-,12+,14+,15-/m0/s1 |
| InChIKey | PPXUZWLSHJRKOK-BTQDYEIMSA-N |
| Mol Weight | 236.35 g/mol |
| Molecular Formula | C15H24O2 |
| Exact Mass | 236.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6MCRMdCgLvT |
|---|---|
| Name | 2.beta.-Hydroxyclovan-9-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.177630011 u |
| Formula | C15H24O2 |
| InChI | InChI=1S/C15H24O2/c1-13(2)8-12(17)15-7-5-11(16)14(3,9-15)6-4-10(13)15/h10,12,17H,4-9H2,1-3H3/t10-,12+,14+,15-/m0/s1 |
| InChIKey | PPXUZWLSHJRKOK-BTQDYEIMSA-N |
| Molecular Weight | 236.355 g/mol |
| SMILES | [C@]123[C@](C(C)(C)C[C@]3(O)[H])(CC[C@@](C1)(C)C(CC2)=O)[H] |