| SpectraBase Compound ID | 172RYFotNhk |
|---|---|
| InChI | InChI=1S/C10H15NS/c1-3-11(4-2)9-5-7-10(12)8-6-9/h5-8,12H,3-4H2,1-2H3 |
| InChIKey | WUBPBSLVSRGNFH-UHFFFAOYSA-N |
| Mol Weight | 181.3 g/mol |
| Molecular Formula | C10H15NS |
| Exact Mass | 181.092521 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Fe6G3SJGwKg |
|---|---|
| Name | Benzenethiol, 4-(diethylamino)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.092520661 u |
| Formula | C10H15NS |
| InChI | InChI=1S/C10H15NS/c1-3-11(4-2)9-5-7-10(12)8-6-9/h5-8,12H,3-4H2,1-2H3 |
| InChIKey | WUBPBSLVSRGNFH-UHFFFAOYSA-N |
| Molecular Weight | 181.297 g/mol |
| SMILES | SC=1C=CC(=CC1)N(CC)CC |
| Spectrum/Structure Validation Score (Raman) | 0.811491 |