| SpectraBase Compound ID | 8bzE999M1oW |
|---|---|
| InChI | InChI=1S/C17H17NO3/c1-3-21-17(20)14-9-7-13(8-10-14)16(19)18-15-6-4-5-12(2)11-15/h4-11H,3H2,1-2H3,(H,18,19) |
| InChIKey | XYHDBBPLHUPIGA-UHFFFAOYSA-N |
| Mol Weight | 283.33 g/mol |
| Molecular Formula | C17H17NO3 |
| Exact Mass | 283.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7UgyuUxBFNR |
|---|---|
| Name | Terephthalic acid, monoamide, N-(3-methylphenyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.120843408 u |
| Formula | C17H17NO3 |
| InChI | InChI=1S/C17H17NO3/c1-3-21-17(20)14-9-7-13(8-10-14)16(19)18-15-6-4-5-12(2)11-15/h4-11H,3H2,1-2H3,(H,18,19) |
| InChIKey | XYHDBBPLHUPIGA-UHFFFAOYSA-N |
| SMILES | CC1=CC=CC(=C1)NC(C1=CC=C(C(OCC)=O)C=C1)=O |