| SpectraBase Compound ID | JGS9CFwy1rd |
|---|---|
| InChI | InChI=1S/C15H14N2O2S/c1-11-3-5-12(6-4-11)15(20)16(2)13-7-9-14(10-8-13)17(18)19/h3-10H,1-2H3 |
| InChIKey | QTFPOSWDYAZSSC-UHFFFAOYSA-N |
| Mol Weight | 286.35 g/mol |
| Molecular Formula | C15H14N2O2S |
| Exact Mass | 286.077599 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ws06WQiArb |
|---|---|
| Name | N-Methyl-4'-nitrothio-p-toluanilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.077598871 u |
| Formula | C15H14N2O2S |
| InChI | InChI=1S/C15H14N2O2S/c1-11-3-5-12(6-4-11)15(20)16(2)13-7-9-14(10-8-13)17(18)19/h3-10H,1-2H3 |
| InChIKey | QTFPOSWDYAZSSC-UHFFFAOYSA-N |
| SMILES | N(=O)(=O)C1=CC=C(C=C1)N(C(C=1C=CC(=CC1)C)=S)C |