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3-PHENYL-4-(4-METHOXYCARBONYLBENZYLIDENAMINO)-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE

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3-PHENYL-4-(4-METHOXYCARBONYLBENZYLIDENAMINO)-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
SpectraBase Compound ID D6PT4Kxmkfv
InChI InChI=1S/C17H14N4O3/c1-24-16(22)14-9-7-12(8-10-14)11-18-21-15(19-20-17(21)23)13-5-3-2-4-6-13/h2-11H,1H3,(H,20,23)/b18-11+
InChIKey UWXIKNZSOJDLJL-WOJGMQOQSA-N
Mol Weight 322.32 g/mol
Molecular Formula C17H14N4O3
Exact Mass 322.10659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DQbiyC2vWJL
Name 3-PHENYL-4-(4-METHOXYCARBONYLBENZYLIDENAMINO)-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14N4O3
InChI InChI=1S/C17H14N4O3/c1-24-16(22)14-9-7-12(8-10-14)11-18-21-15(19-20-17(21)23)13-5-3-2-4-6-13/h2-11H,1H3,(H,20,23)/b18-11+
InChIKey UWXIKNZSOJDLJL-WOJGMQOQSA-N
Literature Reference Author H.YUEKSEK,O.GUERSOY,I.CAKMAK,M.ALKAN
Literature Reference Citation MAGN.RES.CHEM.,43,585(2005)
Literature Reference DOI 10.1002/mrc.1591
Molecular Weight 322.323 g/mol
Sample ID 32800
Solvent DMSO-D6