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1-[[4-(p-bromophenyl)-2-(p-chlorophenyl)-1,3-dioxolan-2-yl]methyl}imidazole, mononitrate
SpectraBase Compound ID C8R3XA9oCVh
InChI InChI=1S/C19H16BrClN2O2.HNO3/c20-16-5-1-14(2-6-16)18-11-24-19(25-18,12-23-10-9-22-13-23)15-3-7-17(21)8-4-15;2-1(3)4/h1-10,13,18H,11-12H2;(H,2,3,4)
InChIKey BGYZQICKFXRDBS-UHFFFAOYSA-N
Mol Weight 482.718 g/mol
Molecular Formula C19H17BrClN3O5
Exact Mass 481.004011 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID I3Dz4FeWKI4
Name 1-{[4-(p-BROMOPHENYL)-2-(p-CHLOROPHENYL)-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 C19H17BrClN3O5
InChI InChI=1S/C19H16BrClN2O2.HNO3/c20-16-5-1-14(2-6-16)18-11-24-19(25-18,12-23-10-9-22-13-23)15-3-7-17(21)8-4-15;2-1(3)4/h1-10,13,18H,11-12H2;(H,2,3,4)
InChIKey BGYZQICKFXRDBS-UHFFFAOYSA-N
Literature Reference J. MED. CHEM. 24, 1360(1981) Abstract-Chemical Abstracts= 95, 161770C(1981)
Melting Point 145.2C
Molecular Weight 482.721008
Synonyms IMIDAZOLE, 1-//4-/P-BROMOPHENYL/- 2-/P-CHLOROPHENYL/-1,3-DIOXOLAN-2-YL/- METHYL/-, MONONITRATE
Technique 4000-1350 CM^-^1=MULLED IN PERFLUORINATED HYDROCARBON; 1350-450 CM^-^1=MULLED IN MINERAL OIL