![o-amino-N-[2-(methylthio)ethyl]benzamide](/api/spectrum/8By4FRV6fTq/structure.png?h=300&w=458 "o-amino-N-[2-(methylthio)ethyl]benzamide")
| SpectraBase Compound ID | KddhDKUGYc3 |
|---|---|
| InChI | InChI=1S/C10H14N2OS/c1-14-7-6-12-10(13)8-4-2-3-5-9(8)11/h2-5H,6-7,11H2,1H3,(H,12,13) |
| InChIKey | OUIXPANUQQPGIN-UHFFFAOYSA-N |
| Mol Weight | 210.29 g/mol |
| Molecular Formula | C10H14N2OS |
| Exact Mass | 210.082684 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8By4FRV6fTq |
|---|---|
| Name | o-Amino-N-[2-(methylthio)ethyl]benzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.082684252 u |
| Formula | C10H14N2OS |
| InChI | InChI=1S/C10H14N2OS/c1-14-7-6-12-10(13)8-4-2-3-5-9(8)11/h2-5H,6-7,11H2,1H3,(H,12,13) |
| InChIKey | OUIXPANUQQPGIN-UHFFFAOYSA-N |
| SMILES | N(C(C=1C(=CC=CC1)N)=O)CCSC |
| Spectrum/Structure Validation Score (Raman) | 0.96453 |