| SpectraBase Compound ID | K0YSi2O0Sfd |
|---|---|
| InChI | InChI=1S/C8H14O2/c1-4-5-6-7(2)10-8(3)9/h6H,4-5H2,1-3H3/b7-6+ |
| InChIKey | XNTIPUTWFZIBDH-VOTSOKGWSA-N |
| Mol Weight | 142.2 g/mol |
| Molecular Formula | C8H14O2 |
| Exact Mass | 142.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 79JJNcRczvK |
|---|---|
| Name | 2-Hexen-2-yl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.099379689 u |
| Formula | C8H14O2 |
| InChI | InChI=1S/C8H14O2/c1-4-5-6-7(2)10-8(3)9/h6H,4-5H2,1-3H3/b7-6+ |
| InChIKey | XNTIPUTWFZIBDH-VOTSOKGWSA-N |
| Molecular Weight | 142.198 g/mol |
| SMILES | C(O\C(=C\CCC)C)(=O)C |