| SpectraBase Compound ID | 95F29Dr03oy |
|---|---|
| InChI | InChI=1S/C10H13NOS/c1-3-12-10(13)11-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,11,13) |
| InChIKey | NMCDNAPZBCSEEG-UHFFFAOYSA-N |
| Mol Weight | 195.28 g/mol |
| Molecular Formula | C10H13NOS |
| Exact Mass | 195.071785 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5VOQEcMJUGG |
|---|---|
| Name | o-Ethyl (p-tolyl)thiocarbamate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.071785216 u |
| Formula | C10H13NOS |
| InChI | InChI=1S/C10H13NOS/c1-3-12-10(13)11-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,11,13) |
| InChIKey | NMCDNAPZBCSEEG-UHFFFAOYSA-N |
| Molecular Weight | 195.280 g/mol |
| SMILES | C1=C(C=CC(=C1)C)NC(=S)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.867661 |