| SpectraBase Compound ID | 9PDCW9Bjjoa |
|---|---|
| InChI | InChI=1S/C13H18ClNO3/c1-17-10-6-7-11(12(9-10)18-2)15-13(16)5-3-4-8-14/h6-7,9H,3-5,8H2,1-2H3,(H,15,16) |
| InChIKey | WJAMNEHCIQQWEY-UHFFFAOYSA-N |
| Mol Weight | 271.74 g/mol |
| Molecular Formula | C13H18ClNO3 |
| Exact Mass | 271.097521 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I12Hyw3nzQD |
|---|---|
| Name | 5-Chlorovaleramide, N-(2,4-dimethoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.097521141 u |
| Formula | C13H18ClNO3 |
| InChI | InChI=1S/C13H18ClNO3/c1-17-10-6-7-11(12(9-10)18-2)15-13(16)5-3-4-8-14/h6-7,9H,3-5,8H2,1-2H3,(H,15,16) |
| InChIKey | WJAMNEHCIQQWEY-UHFFFAOYSA-N |
| Molecular Weight | 271.744 g/mol |
| SMILES | C(CCCl)CC(=O)NC1=C(OC)C=C(OC)C=C1 |