| SpectraBase Compound ID | J065DWF2Sc2 |
|---|---|
| InChI | InChI=1S/C19H35ClO4/c1-2-3-16-23-18(21)13-9-8-10-14-19(22)24-17-12-7-5-4-6-11-15-20/h2-17H2,1H3 |
| InChIKey | AVICAYIOFFYJKS-UHFFFAOYSA-N |
| Mol Weight | 362.9 g/mol |
| Molecular Formula | C19H35ClO4 |
| Exact Mass | 362.222387 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HoFAKYBBZy8 |
|---|---|
| Name | Pimelic acid, 8-chlorooctyl butyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H35ClO4 |
| InChI | InChI=1S/C19H35ClO4/c1-2-3-16-23-18(21)13-9-8-10-14-19(22)24-17-12-7-5-4-6-11-15-20/h2-17H2,1H3 |
| InChIKey | AVICAYIOFFYJKS-UHFFFAOYSA-N |
| Molecular Weight | 362.938 g/mol |
| SMILES | C(CCCCCC(OCCCCCCCCCl)=O)(OCCCC)=O |
| SPLASH | splash10-054p-7900000000-9088af8c7f33b8dd080f |
| Source of Spectrum | TIPS-2022-840-0 |
| Wiley ID | 1822357 |