| SpectraBase Compound ID | s7OcWIIjrI |
|---|---|
| InChI | InChI=1S/C8H17NOS/c1-4-6-9(7-5-2)8(11)10-3/h4-7H2,1-3H3 |
| InChIKey | BMGULSOUUKULAV-UHFFFAOYSA-N |
| Mol Weight | 175.29 g/mol |
| Molecular Formula | C8H17NOS |
| Exact Mass | 175.103085 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7xwQel6k5D7 |
|---|---|
| Name | o-Methyl dipropylcarbamothioate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.103085344 u |
| Formula | C8H17NOS |
| InChI | InChI=1S/C8H17NOS/c1-4-6-9(7-5-2)8(11)10-3/h4-7H2,1-3H3 |
| InChIKey | BMGULSOUUKULAV-UHFFFAOYSA-N |
| Molecular Weight | 175.290 g/mol |
| SMILES | C(=S)(N(CCC)CCC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.904958 |