![N-[(thiocarbamoyl)methyl]benzamide](/api/spectrum/8JipOsthh6b/structure.png?h=300&w=458 "N-[(thiocarbamoyl)methyl]benzamide")
| SpectraBase Compound ID | 74vRuGqV4Sb |
|---|---|
| InChI | InChI=1S/C9H10N2OS/c10-8(13)6-11-9(12)7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,13)(H,11,12) |
| InChIKey | JGQSPWXCUZDDHM-UHFFFAOYSA-N |
| Mol Weight | 194.25 g/mol |
| Molecular Formula | C9H10N2OS |
| Exact Mass | 194.051384 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8JipOsthh6b |
|---|---|
| Name | N-[(Thiocarbamoyl)methyl]benzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.051384123 u |
| Formula | C9H10N2OS |
| InChI | InChI=1S/C9H10N2OS/c10-8(13)6-11-9(12)7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,13)(H,11,12) |
| InChIKey | JGQSPWXCUZDDHM-UHFFFAOYSA-N |
| Molecular Weight | 194.252 g/mol |
| SMILES | N(C(C1=CC=CC=C1)=O)CC(N)=S |
| Spectrum/Structure Validation Score (Raman) | 0.954692 |