| SpectraBase Spectrum ID |
JBaLlivu7aR |
| Name |
Fipronil |
| Source of Sample |
Sigma-Aldrich Cat. #46451 |
| CAS Registry Number |
120068-37-3 |
| Classification |
Pesticides: Insecticides |
| 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 |
435.938706316 u |
| Formula |
C12H4Cl2F6N4OS |
| InChI |
InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2 |
| InChIKey |
ZOCSXAVNDGMNBV-UHFFFAOYSA-N |
| Molecular Weight |
437.147 g/mol |
| Number of Peaks |
376 |
| RI1 |
2051 |
| SMILES |
Nc1c(S(=O)C(F)(F)F)c(C#N)n[n]1-c1c(cc(C(F)(F)F)cc1Cl)Cl |
| SPLASH |
splash10-0gb9-2369200000-f38c25b38d5db5a1a558 |
| 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)sulfinyl]- |
| Wiley ID |
LM_PEST_100 |
