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5-(1-NAPHTHYLMETHYL)-4-(PARA-CHLOROPHENYLIDENE)-AMINO-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
SpectraBase Compound ID CCiTCEBA1oL
InChI InChI=1S/C20H15ClN4S/c21-17-10-8-14(9-11-17)13-22-25-19(23-24-20(25)26)12-16-6-3-5-15-4-1-2-7-18(15)16/h1-11,13H,12H2,(H,24,26)/b22-13+
InChIKey SUUVFXYUHQOQTA-LPYMAVHISA-N
Mol Weight 378.88 g/mol
Molecular Formula C20H15ClN4S
Exact Mass 378.070595 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wNL13x22bW
Name 5-(1-NAPHTHYLMETHYL)-4-(PARA-CHLOROPHENYLIDENE)-AMINO-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H15ClN4S
InChI InChI=1S/C20H15ClN4S/c21-17-10-8-14(9-11-17)13-22-25-19(23-24-20(25)26)12-16-6-3-5-15-4-1-2-7-18(15)16/h1-11,13H,12H2,(H,24,26)/b22-13+
InChIKey SUUVFXYUHQOQTA-LPYMAVHISA-N
Literature Reference Author A.ZHANG,L.ZHANG,X.LEI
Literature Reference Citation MAGN.RES.CHEM.,44,813(2006)
Literature Reference DOI 10.1002/mrc.1829
Molecular Weight 378.879 g/mol
Sample ID 52660
Solvent DMSO-D6