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Azaconazole
SpectraBase Compound ID Fyq3NcMx1Um
InChI InChI=1S/C12H11Cl2N3O2/c13-9-1-2-10(11(14)5-9)12(18-3-4-19-12)6-17-8-15-7-16-17/h1-2,5,7-8H,3-4,6H2
InChIKey AKNQMEBLVAMSNZ-UHFFFAOYSA-N
Mol Weight 300.15 g/mol
Molecular Formula C12H11Cl2N3O2
Exact Mass 299.022832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYyIq0RgkOc
Name Azaconazole
Source of Sample Sigma-Aldrich Cat. #34045
CAS Registry Number 60207-31-0
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 299.022832004 u
Formula C12H11Cl2N3O2
InChI InChI=1S/C12H11Cl2N3O2/c13-9-1-2-10(11(14)5-9)12(18-3-4-19-12)6-17-8-15-7-16-17/h1-2,5,7-8H,3-4,6H2
InChIKey AKNQMEBLVAMSNZ-UHFFFAOYSA-N
Molecular Weight 300.145 g/mol
Number of Peaks 47
RI1 2197
SMILES c1(Cl)c(ccc(c1)Cl)C1(OCCO1)C[n]1ncnc1
SPLASH splash10-014i-6970000000-7878c1f186d4ffa18589
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-[[2-(2,4-dichlorophenyl)-1,3-dioxolan-2-yl]methyl]-
Wiley ID LM_PEST_155