![Ethyl 4-[(anilinocarbothioyl)amino]benzoate](/api/spectrum/LUCjjVcFM6a/structure.png?h=300&w=458 "Ethyl 4-[(anilinocarbothioyl)amino]benzoate")
| SpectraBase Compound ID | 7Sp3EcGI3QP |
|---|---|
| InChI | InChI=1S/C16H16N2O2S/c1-2-20-15(19)12-8-10-14(11-9-12)18-16(21)17-13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H2,17,18,21) |
| InChIKey | FUBMAKIAKSVODK-UHFFFAOYSA-N |
| Mol Weight | 300.38 g/mol |
| Molecular Formula | C16H16N2O2S |
| Exact Mass | 300.093249 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LUCjjVcFM6a |
|---|---|
| Name | Ethyl 4-[(anilinocarbothioyl)amino]benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.093248935 u |
| Formula | C16H16N2O2S |
| InChI | InChI=1S/C16H16N2O2S/c1-2-20-15(19)12-8-10-14(11-9-12)18-16(21)17-13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H2,17,18,21) |
| InChIKey | FUBMAKIAKSVODK-UHFFFAOYSA-N |
| Molecular Weight | 300.376 g/mol |
| SMILES | N(C(NC=1C=CC=CC1)=S)C=1C=CC(C(=O)OCC)=CC1 |