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1-[2-(o-chlorophenyl)-3-(2,4-dichlorophenyl)propyl]imidazole, mononitrate

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1-[2-(o-chlorophenyl)-3-(2,4-dichlorophenyl)propyl]imidazole, mononitrate
SpectraBase Compound ID 2JhjEqJmxf2
InChI InChI=1S/C18H15Cl3N2.HNO3/c19-15-6-5-13(18(21)10-15)9-14(11-23-8-7-22-12-23)16-3-1-2-4-17(16)20;2-1(3)4/h1-8,10,12,14H,9,11H2;(H,2,3,4)
InChIKey RUCSEELQORHLMJ-UHFFFAOYSA-N
Mol Weight 428.7 g/mol
Molecular Formula C18H16Cl3N3O3
Exact Mass 427.025724 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID DZFgy0HoKDS
Name 1-[2-(o-CHLOROPHENYL)-3-(2,4-DICHLOROPHENYL)PROPYL]IMIDAZOLE, MONONITRATE
Source of Sample J. Heeres, Janssen Pharmaceutica, Beerse, Belgium
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16Cl3N3O3
InChI InChI=1S/C18H15Cl3N2.HNO3/c19-15-6-5-13(18(21)10-15)9-14(11-23-8-7-22-12-23)16-3-1-2-4-17(16)20;2-1(3)4/h1-8,10,12,14H,9,11H2;(H,2,3,4)
InChIKey RUCSEELQORHLMJ-UHFFFAOYSA-N
Literature Reference J. MED. CHEM. 20, 1511(1977) Abstract-Chemical Abstracts= 87, 201405(1977)
Melting Point 142.7C
Molecular Weight 428.694000
Synonyms IMIDAZOLE, 1-/2-/O-CHLOROPHENYL/- 3-/2,4-DICHLOROPHENYL/PROPYL/-, MONO- NITRATE
Technique KBr WAFER