| SpectraBase Compound ID | GO7AMDjG0gc |
|---|---|
| InChI | InChI=1S/C6H11NS/c1-4-5-6(8)7(2)3/h4-5H,1-3H3/b5-4+ |
| InChIKey | MAXGSKFPNVWNSQ-SNAWJCMRSA-N |
| Mol Weight | 129.22 g/mol |
| Molecular Formula | C6H11NS |
| Exact Mass | 129.061221 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DIAparjxiUW |
|---|---|
| Name | (E)-N,N-Dimethyl-2-butenethioamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 129.061220532 u |
| Formula | C6H11NS |
| InChI | InChI=1S/C6H11NS/c1-4-5-6(8)7(2)3/h4-5H,1-3H3/b5-4+ |
| InChIKey | MAXGSKFPNVWNSQ-SNAWJCMRSA-N |
| Molecular Weight | 129.221 g/mol |
| SMILES | C(=S)(N(C)C)\C=C\C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937211 |