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Rimonabant

View entire compound with spectra: 1 NMR, 2 FTIR, 1 Raman, and 4 MS (GC)

Rimonabant
SpectraBase Compound ID F2OrD2NnHRR
InChI InChI=1S/C22H21Cl3N4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)
InChIKey JZCPYUJPEARBJL-UHFFFAOYSA-N
Mol Weight 463.8 g/mol
Molecular Formula C22H21Cl3N4O
Exact Mass 462.078094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNsyc0F6KDV
Name Rimonabant
Alternate Name(s) 5-(4-Chlorophenyl)-1-(2,4-dichloro-phenyl)-4-methyl-N-(piperidin-1-yl)-1H-pyrazole-3-carboxamide 5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(piperidin-1-yl)-1H-pyrazole-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21Cl3N4O
InChI InChI=1S/C22H21Cl3N4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)
InChIKey JZCPYUJPEARBJL-UHFFFAOYSA-N
Molecular Weight 463.796 g/mol
SMILES N(N1CCCCC1)C(=O)c1n[n](c(c1C)-c1ccc(cc1)Cl)-c1c(cc(cc1)Cl)Cl
SPLASH splash10-001i-9313000000-c2a0748dc523d7b0c525
Source of Spectrum SWG-33-3060-0
Wiley ID 1810022