| SpectraBase Compound ID | BYCp2gYLckR |
|---|---|
| InChI | InChI=1S/C7H12N2O2S/c1-6(10)8-7(12)9-2-4-11-5-3-9/h2-5H2,1H3,(H,8,10,12) |
| InChIKey | YAKFNYGPXYSNII-UHFFFAOYSA-N |
| Mol Weight | 188.24 g/mol |
| Molecular Formula | C7H12N2O2S |
| Exact Mass | 188.061949 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IbVZ3ofpSPx |
|---|---|
| Name | N-(Morpholin-4-carbothioyl)acetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.061948806 u |
| Formula | C7H12N2O2S |
| InChI | InChI=1S/C7H12N2O2S/c1-6(10)8-7(12)9-2-4-11-5-3-9/h2-5H2,1H3,(H,8,10,12) |
| InChIKey | YAKFNYGPXYSNII-UHFFFAOYSA-N |
| Molecular Weight | 188.245 g/mol |
| SMILES | C(NC(=S)N1CCOCC1)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.860418 |