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Oxiconazole nitrate
SpectraBase Compound ID L6DRbeIvrBN
InChI InChI=1S/C18H13Cl4N3O.HNO3/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;2-1(3)4/h1-8,11H,9-10H2;(H,2,3,4)/b24-18+;
InChIKey WVNOAGNOIPTWPT-NDUABGMUSA-N
Mol Weight 492.146 g/mol
Molecular Formula C18H14Cl4N4O4
Exact Mass 489.976916 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 2pGj4jpv5ud
Name Oxiconazole nitrate
Source of Sample Cayman Chemical Company
Catalog Number 18724
Lot Number 0475886-4
CAS Registry Number 64211-46-7
Cell Type NMR tube
Compound Type Pure
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Formula C18H14Cl4N4O4
IUPAC Name (1Z)-O-[(2,4-Dichlorophenyl)methyl]oxime 1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethanone, mononitrate
InChI InChI=1S/C18H13Cl4N3O.HNO3/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;2-1(3)4/h1-8,11H,9-10H2;(H,2,3,4)/b24-18+;
InChIKey WVNOAGNOIPTWPT-NDUABGMUSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 903 mW
Raman Laser Source Nd:YAG
SMILES c1c(ccc(c1Cl)\C(=N\OCc1c(cc(cc1)Cl)Cl)C[n]1cncc1)Cl.O[N+](=O)[O-]
Scans Performed 1856
Source of Spectrum Forensic Spectral Research
Synonyms Ro 13-8996
Technique FT-Raman