SpectraBase Spectrum ID |
DBVuhUi1WX8 |
Name |
Epoxiconazol |
Source of Sample |
Sigma-Aldrich Cat. #36848 |
CAS Registry Number |
133855-98-8 |
Classification |
Pesticides: Fungicides |
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 |
329.073117913 u |
Formula |
C17H13ClFN3O |
InChI |
InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m0/s1 |
InChIKey |
ZMYFCFLJBGAQRS-IRXDYDNUSA-N |
Molecular Weight |
329.762 g/mol |
Number of Peaks |
50 |
RI1 |
2413 |
SMILES |
c1n[n](cn1)C[C@@]1([C@@](O1)(c1c(cccc1)Cl)[H])c1ccc(cc1)F |
SPLASH |
splash10-0006-2900000000-1a289d58f2d028f3caea |
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-1,2,4-Triazole, 1-[[(2R,3S)-3-(2-chlorophenyl)-2-(4-fluorophenyl)-2-oxiranyl]methyl]-, rel- |
Wiley ID |
LM_PEST_171 |