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4-(1,1-DIPHENYL-1-HYDROXYMETHANECARBONYLAMINO)-3-(1,1-DIPHENYL-1-HYDROXYMETHYL)-5-ETHYL-1,2,4-TRIAZOLE
SpectraBase Compound ID HkzziiPZYgL
InChI InChI=1S/C31H28N4O3/c1-2-27-32-33-28(30(37,23-15-7-3-8-16-23)24-17-9-4-10-18-24)35(27)34-29(36)31(38,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22,37-38H,2H2,1H3,(H,34,36)
InChIKey XPXIDVKQMNGWJV-UHFFFAOYSA-N
Mol Weight 504.59 g/mol
Molecular Formula C31H28N4O3
Exact Mass 504.216141 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 81gRt7djUJ7
Name 4-(1,1-DIPHENYL-1-HYDROXYMETHANECARBONYLAMINO)-3-(1,1-DIPHENYL-1-HYDROXYMETHYL)-5-ETHYL-1,2,4-TRIAZOLE
Compound Number 4I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28N4O3
InChI InChI=1S/C31H28N4O3/c1-2-27-32-33-28(30(37,23-15-7-3-8-16-23)24-17-9-4-10-18-24)35(27)34-29(36)31(38,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22,37-38H,2H2,1H3,(H,34,36)
InChIKey XPXIDVKQMNGWJV-UHFFFAOYSA-N
Literature Reference Author W.ZIELINSKI,A.KUDELKO,W.CZARDYBON
Literature Reference Citation J.HETCYCL.CHEM.,42,1393(2005)
Literature Reference DOI 10.1002/jhet.5570420720
Molecular Weight 504.588 g/mol
Sample ID 53159
Solvent DMSO