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1-{[4-(2,4-DICHLOROPHENYL)-2-PHENYL-1,3-DIOXOLAN-2-YL]METHYL}IMIDAZOLE, MONONITRATE
SpectraBase Compound ID AzR1AUIoSqb
InChI InChI=1S/C19H16Cl2N2O2.HNO3/c20-15-6-7-16(17(21)10-15)18-11-24-19(25-18,12-23-9-8-22-13-23)14-4-2-1-3-5-14;2-1(3)4/h1-10,13,18H,11-12H2;(H,2,3,4)
InChIKey CLDMTQWJFFKLMC-UHFFFAOYSA-N
Mol Weight 438.27 g/mol
Molecular Formula C19H17Cl2N3O5
Exact Mass 437.054526 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 8wHaJAa5pmV
Name 1-{[4-(2,4-DICHLOROPHENYL)-2-PHENYL-1,3-DIOXOLAN-2-YL]METHYL}IMIDAZOLE, MONONITRATE
Source of Sample J. Heeres, Janssen Pharmaceutica, Beerse, Belgium
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17Cl2N3O5
InChI InChI=1S/C19H16Cl2N2O2.HNO3/c20-15-6-7-16(17(21)10-15)18-11-24-19(25-18,12-23-9-8-22-13-23)14-4-2-1-3-5-14;2-1(3)4/h1-10,13,18H,11-12H2;(H,2,3,4)
InChIKey CLDMTQWJFFKLMC-UHFFFAOYSA-N
Literature Reference J. MED. CHEM. 24, 1360(1981) Abstract-Chemical Abstracts= 95, 161770C(1981)
Melting Point 163.8C
Molecular Weight 438.260986
Synonyms IMIDAZOLE, 1-//4-/2,4-DICHLORO- PHENYL/-2-PHENYL-1,3-DIOXOLAN-2-YL/- METHYL/-, MONONITRATE
Technique 4000-1350 CM^-^1=MULLED IN PERFLUORINATED HYDROCARBON; 1350-450 CM^-^1=MULLED IN MINERAL OIL