| SpectraBase Compound ID | 4roifDkC8AM |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-4-7-17-13(16)12(15)14-11-6-5-9(2)10(3)8-11/h5-6,8H,4,7H2,1-3H3,(H,14,15) |
| InChIKey | AYRTVHKRFKWHTH-UHFFFAOYSA-N |
| Mol Weight | 235.28 g/mol |
| Molecular Formula | C13H17NO3 |
| Exact Mass | 235.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FqlXar3y54B |
|---|---|
| Name | Oxalic acid, monoamide, N-(3,4-dimethylphenyl)-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.120843408 u |
| Formula | C13H17NO3 |
| InChI | InChI=1S/C13H17NO3/c1-4-7-17-13(16)12(15)14-11-6-5-9(2)10(3)8-11/h5-6,8H,4,7H2,1-3H3,(H,14,15) |
| InChIKey | AYRTVHKRFKWHTH-UHFFFAOYSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | C1(=C(C=CC(=C1)NC(C(OCCC)=O)=O)C)C |