| SpectraBase Spectrum ID |
LqLwstgfbBd |
| Name |
2,3,4,5,6-Pentafluoro thiobenzophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.003212150 u |
| Formula |
C13H5F5S |
| InChI |
InChI=1S/C13H5F5S/c14-8-7(9(15)11(17)12(18)10(8)16)13(19)6-4-2-1-3-5-6/h1-5H |
| InChIKey |
MBFQRRCZZFSHLX-UHFFFAOYSA-N |
| Molecular Weight |
288.235 g/mol |
| SMILES |
C=1(C(=C(F)C(=C(C1F)F)F)F)C(=S)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.829579 |
