| SpectraBase Compound ID | 7yrlcSh5hKa |
|---|---|
| InChI | InChI=1S/C13H13NS/c1-14-11-7-9-13(10-8-11)15-12-5-3-2-4-6-12/h2-10,14H,1H3 |
| InChIKey | RPPNNTBEYGLDRA-UHFFFAOYSA-N |
| Mol Weight | 215.31 g/mol |
| Molecular Formula | C13H13NS |
| Exact Mass | 215.076871 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3UsvaU6gaD0 |
|---|---|
| Name | N-Methyl-4-(phenylthio)aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.076870597 u |
| Formula | C13H13NS |
| InChI | InChI=1S/C13H13NS/c1-14-11-7-9-13(10-8-11)15-12-5-3-2-4-6-12/h2-10,14H,1H3 |
| InChIKey | RPPNNTBEYGLDRA-UHFFFAOYSA-N |
| Molecular Weight | 215.314 g/mol |
| SMILES | C=1(SC2=CC=CC=C2)C=CC(=CC1)NC |