| SpectraBase Compound ID | DIomOgrAFLc |
|---|---|
| InChI | InChI=1S/C14H18O2/c1-12(11-16-13(2)15)7-6-10-14-8-4-3-5-9-14/h3-5,8-9,11H,6-7,10H2,1-2H3/b12-11+ |
| InChIKey | VIWUDDOVVCFXEQ-VAWYXSNFSA-N |
| Mol Weight | 218.3 g/mol |
| Molecular Formula | C14H18O2 |
| Exact Mass | 218.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GsSsxjPhx7F |
|---|---|
| Name | (E) and (Z)-1-Acetoxy-2-methyl-5-phenyl-1-pentene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.130679818 u |
| Formula | C14H18O2 |
| InChI | InChI=1S/C14H18O2/c1-12(11-16-13(2)15)7-6-10-14-8-4-3-5-9-14/h3-5,8-9,11H,6-7,10H2,1-2H3/b12-11+ |
| InChIKey | VIWUDDOVVCFXEQ-VAWYXSNFSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | C(O\C=C\(CCCC=1C=CC=CC1)C)(=O)C |