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Omoconazole
SpectraBase Compound ID 3IrnZQUK4V5
InChI InChI=1S/C20H17Cl3N2O2/c1-14(25-9-8-24-13-25)20(18-7-4-16(22)12-19(18)23)27-11-10-26-17-5-2-15(21)3-6-17/h2-9,12-13H,10-11H2,1H3/b20-14-
InChIKey JMFOSJNGKJCTMJ-ZHZULCJRSA-N
Mol Weight 423.73 g/mol
Molecular Formula C20H17Cl3N2O2
Exact Mass 422.035561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mncpIuq5y4
Name Omoconazole
CAS Registry Number 105102-19-0
Classification Pharmaceutical drug, antifungal
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 422.035560893 u
Formula C20H17Cl3N2O2
InChI InChI=1S/C20H17Cl3N2O2/c1-14(25-9-8-24-13-25)20(18-7-4-16(22)12-19(18)23)27-11-10-26-17-5-2-15(21)3-6-17/h2-9,12-13H,10-11H2,1H3/b20-14-
InChIKey JMFOSJNGKJCTMJ-ZHZULCJRSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 423.727 g/mol
Nominal Mass 422 u
Quality 906
Retention Index 3112
SMILES C=1(\C(=C/(N2C=CN=C2)C)OCCOC2=CC=C(C=C2)Cl)C(=CC(=CC1)Cl)Cl
SPLASH splash10-01xt-4941000000-a03afb12e809f52974fc
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Omoconazol Omoconazolum 1-[(Z)-1-[2-(4-Chlorophenoxy)ethoxy]-1-(2,4-dichlorophenyl)prop-1-en-2-yl]imidazole
Technique GC/MS
Wiley ID DD2024_011847