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(+/-)-1-(CYCLOHEXYLOXYCARBONYLOXY)-ETHYL-2-ETHOXY-1-[[2'-(1H-TETRAZOL-5-YL)-BIPHENYL-4-YL]-METHYL]-1H-BENZIMIDAZOLE-7-CARBOXYLATE

View entire compound with spectra: 2 NMR, and 10 MS (LC)

(+/-)-1-(CYCLOHEXYLOXYCARBONYLOXY)-ETHYL-2-ETHOXY-1-[[2'-(1H-TETRAZOL-5-YL)-BIPHENYL-4-YL]-METHYL]-1H-BENZIMIDAZOLE-7-CARBOXYLATE
SpectraBase Compound ID 55CNWcNtaST
InChI InChI=1S/C33H34N6O6/c1-3-42-32-34-28-15-9-14-27(31(40)43-21(2)44-33(41)45-24-10-5-4-6-11-24)29(28)39(32)20-22-16-18-23(19-17-22)25-12-7-8-13-26(25)30-35-37-38-36-30/h7-9,12-19,21,24H,3-6,10-11,20H2,1-2H3,(H,35,36,37,38)
InChIKey GHOSNRCGJFBJIB-UHFFFAOYSA-N
Mol Weight 610.7 g/mol
Molecular Formula C33H34N6O6
Exact Mass 610.253983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KU3mxQ3MTZT
Name (+/-)-1-(CYCLOHEXYLOXYCARBONYLOXY)-ETHYL-2-ETHOXY-1-[[2'-(1H-TETRAZOL-5-YL)-BIPHENYL-4-YL]-METHYL]-1H-BENZIMIDAZOLE-7-CARBOXYLATE
Compound Number TCV-116
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H34N6O6
InChI InChI=1S/C33H34N6O6/c1-3-42-32-34-28-15-9-14-27(31(40)43-21(2)44-33(41)45-24-10-5-4-6-11-24)29(28)39(32)20-22-16-18-23(19-17-22)25-12-7-8-13-26(25)30-35-37-38-36-30/h7-9,12-19,21,24H,3-6,10-11,20H2,1-2H3,(H,35,36,37,38)
InChIKey GHOSNRCGJFBJIB-UHFFFAOYSA-N
Literature Reference Author H.MATSUNAGA,T.EGUCHI,K.NISHIJIMA,T.ENOMOTO,K.SASAOKI,N.NAKAM URA
Literature Reference Citation CHEM.PHARM.BULL.,47,182(1999)
Literature Reference DOI 10.1248/cpb.47.182
Molecular Weight 610.670 g/mol
Solvent DMSO-D6
Source File Reference UWLU7799