| SpectraBase Spectrum ID |
5zA3lNux7ZV |
| Name |
Propenone, 3-(4-chlorophenylthio)-1-(4-fluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
292.012491978 u |
| Formula |
C15H10ClFOS |
| InChI |
InChI=1S/C15H10ClFOS/c16-12-3-7-14(8-4-12)19-10-9-15(18)11-1-5-13(17)6-2-11/h1-10H/b10-9+ |
| InChIKey |
HQHXSVFDCKSTBU-MDZDMXLPSA-N |
| Molecular Weight |
292.755 g/mol |
| SMILES |
C1(C(\C=C\SC2=CC=C(Cl)C=C2)=O)=CC=C(C=C1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87409 |
