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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 CzythOKCRwR
Name Propiconazole
CAS Registry Number 60207-90-1
Classification Fungicide
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Exact Mass 341.069782197 u
Formula C15H17Cl2N3O2
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
Ionization Type Electron Ionization (EI)
Molecular Weight 342.226 g/mol
SMILES c1c(Cl)cc(c(C2(OC(CO2)CCC)C[n]2cncn2)c1)Cl
SPLASH splash10-06fr-5930000000-024f7eda1261c3c76e06
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_3488