| SpectraBase Spectrum ID |
3Ojgytxh5QB |
| Name |
4-Chloronaphtyl-4-fluorophenylsulfone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.007406597 u |
| Formula |
C16H10ClFO2S |
| InChI |
InChI=1S/C16H10ClFO2S/c17-15-9-10-16(14-4-2-1-3-13(14)15)21(19,20)12-7-5-11(18)6-8-12/h1-10H |
| InChIKey |
SQRSIVXYWMQTKB-UHFFFAOYSA-N |
| Molecular Weight |
320.765 g/mol |
| SMILES |
C1(S(=O)(C2=CC=C(C3=C2C=CC=C3)Cl)=O)=CC=C(C=C1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.815546 |
