![2-[(1S)-4-methyl-3-cyclohexen-1-yl]-2-propenyl 2-methylbutanoate](/api/spectrum/7D924jOjIaS/structure.png?h=300&w=458 "2-[(1S)-4-methyl-3-cyclohexen-1-yl]-2-propenyl 2-methylbutanoate")
| SpectraBase Compound ID | 85zPPfweBhc |
|---|---|
| InChI | InChI=1S/C15H24O2/c1-5-12(3)15(16)17-10-13(4)14-8-6-11(2)7-9-14/h6,12,14H,4-5,7-10H2,1-3H3/t12?,14-/m1/s1 |
| InChIKey | OLWOEFWQNHUNEO-TYZXPVIJSA-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 | 7D924jOjIaS |
|---|---|
| Name | 2-[(1S)-4-Methyl-3-cyclohexen-1-yl]-2-propenyl 2-methylbutanoate |
| 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/c1-5-12(3)15(16)17-10-13(4)14-8-6-11(2)7-9-14/h6,12,14H,4-5,7-10H2,1-3H3/t12?,14-/m1/s1 |
| InChIKey | OLWOEFWQNHUNEO-TYZXPVIJSA-N |
| Molecular Weight | 236.355 g/mol |
| SMILES | C(C(C)CC)(=O)OCC(=C)[C@]1(CCC(=CC1)C)[H] |