| SpectraBase Compound ID | 1Vadwn42ECk |
|---|---|
| InChI | InChI=1S/C17H23ClO/c1-15(11-12-18)7-6-8-16(2)13-19-14-17-9-4-3-5-10-17/h3-5,8-11H,6-7,12-14H2,1-2H3/b15-11+,16-8+ |
| InChIKey | FUYXTBGFTJMGPV-ZYHSJPTQSA-N |
| Mol Weight | 278.82 g/mol |
| Molecular Formula | C17H23ClO |
| Exact Mass | 278.143743 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9yOpOT2cCl7 |
|---|---|
| Name | 8-Benzyloxy-3,7-dimethyl-(2E,6E)-2,6-octadienyl chloride |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.143743060 u |
| Formula | C17H23ClO |
| InChI | InChI=1S/C17H23ClO/c1-15(11-12-18)7-6-8-16(2)13-19-14-17-9-4-3-5-10-17/h3-5,8-11H,6-7,12-14H2,1-2H3/b15-11+,16-8+ |
| InChIKey | FUYXTBGFTJMGPV-ZYHSJPTQSA-N |
| SMILES | C(\C=C\(CC\C=C\(COCC=1C=CC=CC1)C)C)Cl |