| SpectraBase Compound ID | A99aZ9ozryC |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-9(2)7-13(15)14-11-6-5-10(16-3)8-12(11)17-4/h5-8H,1-4H3,(H,14,15) |
| InChIKey | DZBXAHATMWOJBT-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 | 1Mn48oexGkF |
|---|---|
| Name | but-2-Enoic acid, amide, 3-methyl-N-(2,4-dimethoxyphenyl)- |
| 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/c1-9(2)7-13(15)14-11-6-5-10(16-3)8-12(11)17-4/h5-8H,1-4H3,(H,14,15) |
| InChIKey | DZBXAHATMWOJBT-UHFFFAOYSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | C(=C(C)C)C(=O)NC1=CC=C(OC)C=C1OC |