| SpectraBase Compound ID | LlWnUlhzn26 |
|---|---|
| InChI | InChI=1S/C17H16ClNO5/c1-22-14-8-12(17(21)24-3)13(9-15(14)23-2)19-16(20)10-4-6-11(18)7-5-10/h4-9H,1-3H3,(H,19,20) |
| InChIKey | NPRKKMXTTOQQRW-UHFFFAOYSA-N |
| Mol Weight | 349.77 g/mol |
| Molecular Formula | C17H16ClNO5 |
| Exact Mass | 349.0717 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ll1Nr4C5h5W |
|---|---|
| Name | Methyl 2-(4-chlorobenzamido)-4,5-dimethoxybenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 349.071700314 u |
| Formula | C17H16ClNO5 |
| InChI | InChI=1S/C17H16ClNO5/c1-22-14-8-12(17(21)24-3)13(9-15(14)23-2)19-16(20)10-4-6-11(18)7-5-10/h4-9H,1-3H3,(H,19,20) |
| InChIKey | NPRKKMXTTOQQRW-UHFFFAOYSA-N |
| Molecular Weight | 349.770 g/mol |
| SMILES | C1(=CC(=C(C=C1OC)C(OC)=O)NC(=O)C1=CC=C(C=C1)Cl)OC |