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

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3-BENZYL-4-(4-METHOXYCARBONYLBENZYLIDENAMINO)-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
SpectraBase Compound ID L6SsRd28TfW
InChI InChI=1S/C18H16N4O3/c1-25-17(23)15-9-7-14(8-10-15)12-19-22-16(20-21-18(22)24)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,21,24)/b19-12+
InChIKey MAPWXAAOYFPZRT-XDHOZWIPSA-N
Mol Weight 336.35 g/mol
Molecular Formula C18H16N4O3
Exact Mass 336.12224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 50TVBrusUZq
Name 3-BENZYL-4-(4-METHOXYCARBONYLBENZYLIDENAMINO)-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16N4O3
InChI InChI=1S/C18H16N4O3/c1-25-17(23)15-9-7-14(8-10-15)12-19-22-16(20-21-18(22)24)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,21,24)/b19-12+
InChIKey MAPWXAAOYFPZRT-XDHOZWIPSA-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 336.350 g/mol
Sample ID 32799
Solvent DMSO-D6