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Propiconazole
SpectraBase Compound ID AOZFHA89xpH
InChI InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3
InChIKey STJLVHWMYQXCPB-UHFFFAOYSA-N
Mol Weight 342.23 g/mol
Molecular Formula C15H17Cl2N3O2
Exact Mass 341.069782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2lxkpwGXAs
Name Propiconazole-I
Carrier Gas Helium (1.0 mL/min)
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Exact Mass 341.069782197 u
Formula C15H17Cl2N3O2
GC Column DB-5 fused-silica (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 260oC
InChI InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3
InChIKey STJLVHWMYQXCPB-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-Agilent 7683 series
Ionization Type EI
Literature Reference DOI 10.1002/jssc.200700052
Molecular Weight 342.226 g/mol
Quality 1
SMILES CCCC1COC(O1)(CN1C=NC=N1)C1=C(C=C(C=C1)Cl)Cl
SPLASH splash10-0a6r-0590000000-a5b42ff37f25bb4539cc
Source of Spectrum SEP-30-2099-Propiconazole-I (DOI: 10.1002/jssc.200700052)
Wiley ID 1906212