| SpectraBase Spectrum ID |
VP61UPIDxw |
| Name |
Fipronil sulfone |
| Source of Sample |
LGC Cat. #DRE-C13645500; www.lgcstandards.com |
| CAS Registry Number |
120068-36-2 |
| 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 |
451.933620935 u |
| Formula |
C12H4Cl2F6N4O2S |
| InChI |
InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2 |
| InChIKey |
LGHZJDKSVUTELU-UHFFFAOYSA-N |
| Molecular Weight |
453.146 g/mol |
| Number of Peaks |
373 |
| RI1 |
2180 |
| RI2 |
2148 |
| SMILES |
Nc1c(c(n[n]1-c1c(cc(cc1Cl)C(F)(F)F)Cl)C#N)S(=O)(=O)C(F)(F)F |
| SPLASH |
splash10-0bwl-4496100000-eabb4887d4613f56a31b |
| 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 |
1H-Pyrazole-3-carbonitrile, 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfonyl]- |
| Wiley ID |
LM_PEST_1014 |
