| SpectraBase Compound ID | DPG67pXVVKT |
|---|---|
| InChI | InChI=1S/C9H13NS/c1-8-2-4-9(5-3-8)11-7-6-10/h2-5H,6-7,10H2,1H3 |
| InChIKey | UICHAGDPKJUFAE-UHFFFAOYSA-N |
| Mol Weight | 167.27 g/mol |
| Molecular Formula | C9H13NS |
| Exact Mass | 167.076871 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6FzcPnFdDhy |
|---|---|
| Name | 1-Amino-2-p-tolylthioethane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 167.076870597 u |
| Formula | C9H13NS |
| InChI | InChI=1S/C9H13NS/c1-8-2-4-9(5-3-8)11-7-6-10/h2-5H,6-7,10H2,1H3 |
| InChIKey | UICHAGDPKJUFAE-UHFFFAOYSA-N |
| Molecular Weight | 167.270 g/mol |
| SMILES | C(N)CSC=1C=CC(C)=CC1 |