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1-[5-(p-bromophenoxy)-2-(2,4-dichlorophenyl)pentyl]imidazole, oxalate(1:1)
SpectraBase Compound ID C0KJUiVPX7l
InChI InChI=1S/C20H19BrCl2N2O.C2H2O4/c21-16-3-6-18(7-4-16)26-11-1-2-15(13-25-10-9-24-14-25)19-8-5-17(22)12-20(19)23;3-1(4)2(5)6/h3-10,12,14-15H,1-2,11,13H2;(H,3,4)(H,5,6)
InChIKey QIUBGCLGGBAJRR-UHFFFAOYSA-N
Mol Weight 544.23 g/mol
Molecular Formula C22H21BrCl2N2O5
Exact Mass 542.00109 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 677L6fNtB6H
Name 1-[5-(p-BROMOPHENOXY)-2-(2,4-DICHLOROPHENYL)PENTYL]IMIDAZOLE, OXALATE (1:1)
Source of Sample J. Heeres, Janssen Pharmaceutica, Beerse, Belgium
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21BrCl2N2O5
InChI InChI=1S/C20H19BrCl2N2O.C2H2O4/c21-16-3-6-18(7-4-16)26-11-1-2-15(13-25-10-9-24-14-25)19-8-5-17(22)12-20(19)23;3-1(4)2(5)6/h3-10,12,14-15H,1-2,11,13H2;(H,3,4)(H,5,6)
InChIKey QIUBGCLGGBAJRR-UHFFFAOYSA-N
Literature Reference J. MED. CHEM. 20, 1516(1977) Abstract-Chemical Abstracts= 87, 167940(1977)
Melting Point 122.2C
Molecular Weight 544.229004
Synonyms IMIDAZOLE, 1-/5-/P-BROMOPHENOXY/- 2-/2,4-DICHLOROPHENYL/PENTYL/-, OXALATE /1 TO 1/
Technique KBr WAFER