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METHYL-2-CYANO-2-(2,5-DIPHENYL-1,2,4-OXATRIAZOL-3-YL)-ACETATE

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METHYL-2-CYANO-2-(2,5-DIPHENYL-1,2,4-OXATRIAZOL-3-YL)-ACETATE
SpectraBase Compound ID EgS9KEpBQOD
InChI InChI=1S/C18H14N4O2/c1-24-18(23)15(12-19)17-20-16(13-8-4-2-5-9-13)21-22(17)14-10-6-3-7-11-14/h2-11,23H,1H3/b18-15+
InChIKey QANJSASLORROJO-OBGWFSINSA-N
Mol Weight 318.34 g/mol
Molecular Formula C18H14N4O2
Exact Mass 318.111676 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4wRQ88FxsVF
Name METHYL-2-CYANO-2-(2,5-DIPHENYL-1,2,4-OXATRIAZOL-3-YL)-ACETATE
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14N4O2
InChI InChI=1S/C18H14N4O2/c1-24-18(23)15(12-19)17-20-16(13-8-4-2-5-9-13)21-22(17)14-10-6-3-7-11-14/h2-11,23H,1H3/b18-15+
InChIKey QANJSASLORROJO-OBGWFSINSA-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 318.335 g/mol
Solvent CDCl3
Source File Reference UWVP5956