| SpectraBase Compound ID | Hh3bXtcwym4 |
|---|---|
| InChI | InChI=1S/C22H41ClO4/c1-3-4-11-15-20(2)27-22(25)17-14-16-21(24)26-19-13-10-8-6-5-7-9-12-18-23/h20H,3-19H2,1-2H3 |
| InChIKey | XYZGRCMHSGOTPH-UHFFFAOYSA-N |
| Mol Weight | 405.0 g/mol |
| Molecular Formula | C22H41ClO4 |
| Exact Mass | 404.269337 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5e4ziRagppu |
|---|---|
| Name | Glutaric acid, hept-2-yl 10-chlorodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 404.269337496 u |
| Formula | C22H41ClO4 |
| InChI | InChI=1S/C22H41ClO4/c1-3-4-11-15-20(2)27-22(25)17-14-16-21(24)26-19-13-10-8-6-5-7-9-12-18-23/h20H,3-19H2,1-2H3 |
| InChIKey | XYZGRCMHSGOTPH-UHFFFAOYSA-N |
| Molecular Weight | 405.019 g/mol |
| SMILES | C(CCC(OCCCCCCCCCCCl)=O)C(OC(CCCCC)C)=O |