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4-(1,1-DIPHENYL-1-HYDROXYMETHANECARBONYLAMINO)-3-(1,1-DIPHENYL-1-HYDROXYMETHYL)-5-METHYL-1,2,4-TRIAZOLE
SpectraBase Compound ID KpyJn1hAR0R
InChI InChI=1S/C30H26N4O3/c1-22-31-32-27(29(36,23-14-6-2-7-15-23)24-16-8-3-9-17-24)34(22)33-28(35)30(37,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21,36-37H,1H3,(H,33,35)
InChIKey ZHEZQESQNWDQBF-UHFFFAOYSA-N
Mol Weight 490.56 g/mol
Molecular Formula C30H26N4O3
Exact Mass 490.200491 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CZYbROBprsD
Name 4-(1,1-DIPHENYL-1-HYDROXYMETHANECARBONYLAMINO)-3-(1,1-DIPHENYL-1-HYDROXYMETHYL)-5-METHYL-1,2,4-TRIAZOLE
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H26N4O3
InChI InChI=1S/C30H26N4O3/c1-22-31-32-27(29(36,23-14-6-2-7-15-23)24-16-8-3-9-17-24)34(22)33-28(35)30(37,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21,36-37H,1H3,(H,33,35)
InChIKey ZHEZQESQNWDQBF-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 490.561 g/mol
Sample ID 53158
Solvent DMSO