| SpectraBase Compound ID | KplKXAy6RMB |
|---|---|
| InChI | InChI=1S/C13H18ClNO3/c1-17-10-6-7-12(18-2)11(9-10)15-13(16)5-3-4-8-14/h6-7,9H,3-5,8H2,1-2H3,(H,15,16) |
| InChIKey | RUIMICHAILIILK-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 | GvtdYE4uPGB |
|---|---|
| Name | Pentanamide, N-(2,5-dimethoxyphenyl)-5-chloro- |
| 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/c1-17-10-6-7-12(18-2)11(9-10)15-13(16)5-3-4-8-14/h6-7,9H,3-5,8H2,1-2H3,(H,15,16) |
| InChIKey | RUIMICHAILIILK-UHFFFAOYSA-N |
| Molecular Weight | 271.744 g/mol |
| SMILES | COC=1C=CC(OC)=CC1NC(CCCCCl)=O |