For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Oxiconazole
SpectraBase Compound ID 7BssVNDwJLZ
InChI InChI=1S/C18H13Cl4N3O/c19-13-2-1-12(16(21)7-13)10-26-24-18(9-25-6-5-23-11-25)15-4-3-14(20)8-17(15)22/h1-8,11H,9-10H2/b24-18+
InChIKey QRJJEGAJXVEBNE-HKOYGPOVSA-N
Mol Weight 429.1 g/mol
Molecular Formula C18H13Cl4N3O
Exact Mass 426.981273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1MVKWPuHlA
Name Oxiconazole
CAS Registry Number 64211-45-6
Classification Antimycotic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 426.981272850 u
Formula C18H13Cl4N3O
InChI InChI=1S/C18H13Cl4N3O/c19-13-2-1-12(16(21)7-13)10-26-24-18(9-25-6-5-23-11-25)15-4-3-14(20)8-17(15)22/h1-8,11H,9-10H2/b24-18+
InChIKey QRJJEGAJXVEBNE-HKOYGPOVSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 429.134 g/mol
SMILES c1(ccc(Cl)cc1Cl)\C(C[n]1ccnc1)=N\OCc1ccc(cc1Cl)Cl
SPLASH splash10-0bu0-5901000000-1756c8f1f9f02db75a7e
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_2824