| SpectraBase Compound ID | 87FPJGMYJtz |
|---|---|
| InChI | InChI=1S/C5H10N2OS/c6-5(8)4-3-9-2-1-7-4/h4,7H,1-3H2,(H2,6,8) |
| InChIKey | WTBJIFNMKOKRJX-UHFFFAOYSA-N |
| Mol Weight | 146.21 g/mol |
| Molecular Formula | C5H10N2OS |
| Exact Mass | 146.051384 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7oX8tQxlZ1J |
|---|---|
| Name | Thiomorpholine-3-carboxylic acid amide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.051384123 u |
| Formula | C5H10N2OS |
| InChI | InChI=1S/C5H10N2OS/c6-5(8)4-3-9-2-1-7-4/h4,7H,1-3H2,(H2,6,8) |
| InChIKey | WTBJIFNMKOKRJX-UHFFFAOYSA-N |
| SMILES | C(N)(=O)C1NCCSC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.924532 |