| SpectraBase Spectrum ID |
K3dvrIfmd6e |
| Name |
Diphenyl sulfone |
| Source of Sample |
Metabolite of Diphenyl sulfoxide; Sigma-Aldrich Cat. #45458 |
| CAS Registry Number |
127-63-9 |
| Classification |
Pesticides: Metabolites |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
218.040150734 u |
| Formula |
C12H10O2S |
| InChI |
InChI=1S/C12H10O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H |
| InChIKey |
KZTYYGOKRVBIMI-UHFFFAOYSA-N |
| Molecular Weight |
218.270 g/mol |
| Number of Peaks |
46 |
| RI1 |
1916 |
| SMILES |
c1ccc(cc1)S(c1ccccc1)(=O)=O |
| SPLASH |
splash10-004i-7920000000-1b11fda7941c4f35b704 |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzene, 1,1'-sulfonylbis- |
| Wiley ID |
LM_PEST_260 |
