| SpectraBase Compound ID | 8jIferobUNp |
|---|---|
| InChI | InChI=1S/C16H22ClNO3/c1-2-3-4-5-8-11-21-16(20)15(19)18-12-13-9-6-7-10-14(13)17/h6-7,9-10H,2-5,8,11-12H2,1H3,(H,18,19) |
| InChIKey | WIORFAWRIIWSRA-UHFFFAOYSA-N |
| Mol Weight | 311.81 g/mol |
| Molecular Formula | C16H22ClNO3 |
| Exact Mass | 311.128821 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KFE0OjXpXcl |
|---|---|
| Name | Oxalic acid, monoamide, N-(2-chlorobenzyl)-, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.128821269 u |
| Formula | C16H22ClNO3 |
| InChI | InChI=1S/C16H22ClNO3/c1-2-3-4-5-8-11-21-16(20)15(19)18-12-13-9-6-7-10-14(13)17/h6-7,9-10H,2-5,8,11-12H2,1H3,(H,18,19) |
| InChIKey | WIORFAWRIIWSRA-UHFFFAOYSA-N |
| SMILES | C(C(=O)OCCCCCCC)(=O)NCC1=CC=CC=C1Cl |