| SpectraBase Compound ID | JNDaDoGRnBE |
|---|---|
| InChI | InChI=1S/C16H14N2O2S/c1-2-20-12-9-7-11(8-10-12)15(19)18-16-17-13-5-3-4-6-14(13)21-16/h3-10H,2H2,1H3,(H,17,18,19) |
| InChIKey | UQAGFMKLHGHQIQ-UHFFFAOYSA-N |
| Mol Weight | 298.36 g/mol |
| Molecular Formula | C16H14N2O2S |
| Exact Mass | 298.077599 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ErDfoxrsfY |
|---|---|
| Name | N-Benzothiazol-2-yl-4-ethoxy-benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.077598871 u |
| Formula | C16H14N2O2S |
| InChI | InChI=1S/C16H14N2O2S/c1-2-20-12-9-7-11(8-10-12)15(19)18-16-17-13-5-3-4-6-14(13)21-16/h3-10H,2H2,1H3,(H,17,18,19) |
| InChIKey | UQAGFMKLHGHQIQ-UHFFFAOYSA-N |
| SMILES | C12=C(SC(=N2)NC(C2=CC=C(OCC)C=C2)=O)C=CC=C1 |