John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9brClauepHE SpectraBase Spectrum ID=2Aa0nwmfzUi

(accessed ).
3-CYCLOPROPYL-4-(3-CARBOXYPHENYL)-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
SpectraBase Compound ID 9brClauepHE
InChI InChI=1S/C12H11N3O3/c16-11(17)8-2-1-3-9(6-8)15-10(7-4-5-7)13-14-12(15)18/h1-3,6-7H,4-5H2,(H,14,18)(H,16,17)
InChIKey WVZJXXFHLUUDMZ-UHFFFAOYSA-N
Mol Weight 245.24 g/mol
Molecular Formula C12H11N3O3
Exact Mass 245.080041 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Aa0nwmfzUi
Name 3-CYCLOPROPYL-4-(3-CARBOXYPHENYL)-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
Compound Number 2F
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11N3O3
InChI InChI=1S/C12H11N3O3/c16-11(17)8-2-1-3-9(6-8)15-10(7-4-5-7)13-14-12(15)18/h1-3,6-7H,4-5H2,(H,14,18)(H,16,17)
InChIKey WVZJXXFHLUUDMZ-UHFFFAOYSA-N
Literature Reference Author O.G.KOL,H.YUKSEK
Literature Reference Citation ORIENT.J.CHEM.,26,379(2010)
Molecular Weight 245.238 g/mol
Sample ID 73244
Solvent DMSO-D6
SpectraBase Batch ID GyXZzhEG3eE