| SpectraBase Spectrum ID |
IOsjx8pPGut |
| Name |
3-N,N-Dimethylamino-1-(4-fluorophenyl)prop-2-en-1-thione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
209.067448727 u |
| Formula |
C11H12FNS |
| InChI |
InChI=1S/C11H12FNS/c1-13(2)8-7-11(14)9-3-5-10(12)6-4-9/h3-8H,1-2H3/b8-7+ |
| InChIKey |
PNDQGACGEDMBDZ-BQYQJAHWSA-N |
| Molecular Weight |
209.282 g/mol |
| SMILES |
C(\C=C\N(C)C)(C1=CC=C(C=C1)F)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877007 |
