| SpectraBase Compound ID | 9Kpin7hje3E |
|---|---|
| InChI | InChI=1S/C4H9NOS/c1-3-5-4(6)7-2/h3H2,1-2H3,(H,5,6) |
| InChIKey | HILPXMKZHLLNSB-UHFFFAOYSA-N |
| Mol Weight | 119.18 g/mol |
| Molecular Formula | C4H9NOS |
| Exact Mass | 119.040485 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Kj7H0mC8Pmx |
|---|---|
| Name | S-Methyl ethylcarbamothioate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 119.040485087 u |
| Formula | C4H9NOS |
| InChI | InChI=1S/C4H9NOS/c1-3-5-4(6)7-2/h3H2,1-2H3,(H,5,6) |
| InChIKey | HILPXMKZHLLNSB-UHFFFAOYSA-N |
| Molecular Weight | 119.182 g/mol |
| SMILES | C(=O)(NCC)SC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.876171 |