| SpectraBase Compound ID | 5ngmVTH8QS7 |
|---|---|
| InChI | InChI=1S/C15H24O2/c1-12(10-17-11-16)7-8-14-13(2)6-5-9-15(14,3)4/h10-11H,5-9H2,1-4H3/b12-10+ |
| InChIKey | MJURCEOLOMHLAX-ZRDIBKRKSA-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 | 2WSGQDOvpf9 |
|---|---|
| Name | 1-Buten-1-ol, 2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, formate, (E)- |
| 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/c1-12(10-17-11-16)7-8-14-13(2)6-5-9-15(14,3)4/h10-11H,5-9H2,1-4H3/b12-10+ |
| InChIKey | MJURCEOLOMHLAX-ZRDIBKRKSA-N |
| Molecular Weight | 236.355 g/mol |
| SMILES | C(C\C(=C\OC=O)C)C=1C(C)(C)CCCC1C |