| SpectraBase Compound ID | CDHsVDOG0Wn |
|---|---|
| InChI | InChI=1S/C18H26ClNO3/c1-2-3-4-5-6-14-23-18(22)9-7-8-17(21)20-16-12-10-15(19)11-13-16/h10-13H,2-9,14H2,1H3,(H,20,21) |
| InChIKey | XJDLVGOXMLACOR-UHFFFAOYSA-N |
| Mol Weight | 339.86 g/mol |
| Molecular Formula | C18H26ClNO3 |
| Exact Mass | 339.160121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8qpfZUDjvEV |
|---|---|
| Name | Glutaric acid, monoamide, N-(4-chlorophenyl)-, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.160121398 u |
| Formula | C18H26ClNO3 |
| InChI | InChI=1S/C18H26ClNO3/c1-2-3-4-5-6-14-23-18(22)9-7-8-17(21)20-16-12-10-15(19)11-13-16/h10-13H,2-9,14H2,1H3,(H,20,21) |
| InChIKey | XJDLVGOXMLACOR-UHFFFAOYSA-N |
| Molecular Weight | 339.863 g/mol |
| SMILES | CCCCCCCOC(CCCC(NC1=CC=C(C=C1)Cl)=O)=O |