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ETHYL-2,2-BIS-[5-(4-METHYLPHENYL)-2-PHENYL-1,2,4-TRIAZOL-3-YL]-ACETATE
SpectraBase Compound ID 3afAicsIDs5
InChI InChI=1S/C34H30N6O2/c1-4-42-34(41)29(32-35-30(25-19-15-23(2)16-20-25)37-39(32)27-11-7-5-8-12-27)33-36-31(26-21-17-24(3)18-22-26)38-40(33)28-13-9-6-10-14-28/h5-22,29H,4H2,1-3H3
InChIKey AZSAAPLYPUGSBW-UHFFFAOYSA-N
Mol Weight 554.7 g/mol
Molecular Formula C34H30N6O2
Exact Mass 554.243024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9TylrSH018U
Name ETHYL-2,2-BIS-[5-(4-METHYLPHENYL)-2-PHENYL-1,2,4-TRIAZOL-3-YL]-ACETATE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H30N6O2
InChI InChI=1S/C34H30N6O2/c1-4-42-34(41)29(32-35-30(25-19-15-23(2)16-20-25)37-39(32)27-11-7-5-8-12-27)33-36-31(26-21-17-24(3)18-22-26)38-40(33)28-13-9-6-10-14-28/h5-22,29H,4H2,1-3H3
InChIKey AZSAAPLYPUGSBW-UHFFFAOYSA-N
Literature Reference Author R.NEIDLEIN,Z.SUI
Literature Reference Citation HELV.CHIM.ACTA,74,501(1991)
Literature Reference DOI 10.1002/hlca.19910740306
Molecular Weight 554.651 g/mol
Solvent CDCl3
Source File Reference UWVP5955