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1-(2,4-DICHLOROBENZOYL)-3-ISOBUTYL-3-[1-(1'-BENZYL-4'-IMIDAZOLYL)-3-HYDROXYPROP-2(S)-YL]-UREA
SpectraBase Compound ID 2HyLpLBmkYn
InChI InChI=1S/C25H28Cl2N4O3/c1-17(2)12-31(25(34)29-24(33)22-9-8-19(26)10-23(22)27)21(15-32)11-20-14-30(16-28-20)13-18-6-4-3-5-7-18/h3-10,14,16-17,21,32H,11-13,15H2,1-2H3,(H,29,33,34)/t21-/m0/s1
InChIKey HZJIIZHUXNCKCI-NRFANRHFSA-N
Mol Weight 503.43 g/mol
Molecular Formula C25H28Cl2N4O3
Exact Mass 502.153846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Es91LooGRBz
Name 1-(2,4-DICHLOROBENZOYL)-3-ISOBUTYL-3-[1-(1'-BENZYL-4'-IMIDAZOLYL)-3-HYDROXYPROP-2(S)-YL]-UREA
Compound Number 10 E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28Cl2N4O3
InChI InChI=1S/C25H28Cl2N4O3/c1-17(2)12-31(25(34)29-24(33)22-9-8-19(26)10-23(22)27)21(15-32)11-20-14-30(16-28-20)13-18-6-4-3-5-7-18/h3-10,14,16-17,21,32H,11-13,15H2,1-2H3,(H,29,33,34)/t21-/m0/s1
InChIKey HZJIIZHUXNCKCI-NRFANRHFSA-N
Literature Reference Author T.H.KIM,H.RAPOPORT
Literature Reference Citation J.ORG.CHEM.,55,3699(1990)
Literature Reference DOI 10.1021/jo00298a069
Molecular Weight 503.428 g/mol
Solvent CDCl3
Source File Reference UWCS11226