| SpectraBase Compound ID | 7H7tQRM6xE6 |
|---|---|
| InChI | InChI=1S/C20H37ClO4/c1-2-3-4-12-17-24-19(22)14-9-10-15-20(23)25-18-13-8-6-5-7-11-16-21/h2-18H2,1H3 |
| InChIKey | QOKXDWWCPGIUMU-UHFFFAOYSA-N |
| Mol Weight | 377.0 g/mol |
| Molecular Formula | C20H37ClO4 |
| Exact Mass | 376.238037 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 | 3cf25uW1fL7 |
|---|---|
| Name | Adipic acid, 8-chloroctyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 376.238037367 u |
| Formula | C20H37ClO4 |
| InChI | InChI=1S/C20H37ClO4/c1-2-3-4-12-17-24-19(22)14-9-10-15-20(23)25-18-13-8-6-5-7-11-16-21/h2-18H2,1H3 |
| InChIKey | QOKXDWWCPGIUMU-UHFFFAOYSA-N |
| Molecular Weight | 376.965 g/mol |
| SMILES | C(OCCCCCCCCCl)(CCCCC(OCCCCCC)=O)=O |