| SpectraBase Compound ID | 8aWawJhk5St |
|---|---|
| InChI | InChI=1S/C17H23ClO2/c1-13(2)6-4-7-14(3)10-11-20-17(19)15-8-5-9-16(18)12-15/h5-6,8-9,12,14H,4,7,10-11H2,1-3H3 |
| InChIKey | WEZDEOWFQYRKRF-UHFFFAOYSA-N |
| Mol Weight | 294.82 g/mol |
| Molecular Formula | C17H23ClO2 |
| Exact Mass | 294.138658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6mHw70z0JGm |
|---|---|
| Name | 3,7-Dimethyloct-6-enyl 3-chlorobenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.138657679 u |
| Formula | C17H23ClO2 |
| InChI | InChI=1S/C17H23ClO2/c1-13(2)6-4-7-14(3)10-11-20-17(19)15-8-5-9-16(18)12-15/h5-6,8-9,12,14H,4,7,10-11H2,1-3H3 |
| InChIKey | WEZDEOWFQYRKRF-UHFFFAOYSA-N |
| SMILES | CC(C)=CCCC(C)CCOC(=O)C1=CC(=CC=C1)Cl |