| SpectraBase Compound ID | DjAI6NrImfE |
|---|---|
| InChI | InChI=1S/C19H27ClO2/c1-2-3-4-5-6-7-8-9-10-11-15-22-19(21)17-13-12-14-18(20)16-17/h10-14,16H,2-9,15H2,1H3/b11-10+ |
| InChIKey | FNGCCVRQRRRMQZ-ZHACJKMWSA-N |
| Mol Weight | 322.88 g/mol |
| Molecular Formula | C19H27ClO2 |
| Exact Mass | 322.169958 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | PJC7ZWV9a9 |
|---|---|
| Name | (E)-Dodec-2-enyl 3-chlorobenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.169957807 u |
| Formula | C19H27ClO2 |
| InChI | InChI=1S/C19H27ClO2/c1-2-3-4-5-6-7-8-9-10-11-15-22-19(21)17-13-12-14-18(20)16-17/h10-14,16H,2-9,15H2,1H3/b11-10+ |
| InChIKey | FNGCCVRQRRRMQZ-ZHACJKMWSA-N |
| Molecular Weight | 322.876 g/mol |
| SMILES | CCCCCCCCC\C=C\COC(=O)C1=CC(=CC=C1)Cl |