| SpectraBase Compound ID | GyvpYvD1o5m |
|---|---|
| InChI | InChI=1S/C14H22O2/c1-8(2)13(15)16-12-6-9(3)10-7-11(12)14(10,4)5/h6,8,10-12H,7H2,1-5H3 |
| InChIKey | CIXNQBCAZUDGBA-UHFFFAOYSA-N |
| Mol Weight | 222.33 g/mol |
| Molecular Formula | C14H22O2 |
| Exact Mass | 222.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JoMX9FQlfyP |
|---|---|
| Name | (+)-cis-verbenol, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.161979946 u |
| Formula | C14H22O2 |
| InChI | InChI=1S/C14H22O2/c1-8(2)13(15)16-12-6-9(3)10-7-11(12)14(10,4)5/h6,8,10-12H,7H2,1-5H3 |
| InChIKey | CIXNQBCAZUDGBA-UHFFFAOYSA-N |
| Molecular Weight | 222.328 g/mol |
| SMILES | CC1(C)C2CC1C(OC(C(C)C)=O)C=C2C |