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1-(4-Chlorophenyl)-4-[9,10-dihydro-10,9-(epithiomethano)anthracen-12-yl]-1,2,3-triazole
SpectraBase Compound ID 7d2wBdJx0iO
InChI InChI=1S/C23H16ClN3S/c24-14-9-11-15(12-10-14)27-13-20(25-26-27)23-21-16-5-1-3-7-18(16)22(28-23)19-8-4-2-6-17(19)21/h1-13,21-23H/t21-,22+,23?
InChIKey SLZJNBDGCJSPGD-AIZNXBIQSA-N
Mol Weight 401.92 g/mol
Molecular Formula C23H16ClN3S
Exact Mass 401.075346 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8qtiAL9cOSM
Name 1-(4-CHLOROPHENYL)-4-[9,10-DIHYDRO-10,9-(EPITHIOMETHANO)-ANTHRACEN-12-YL]-1,2,3-TRIAZOLE
Compound Number 7G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H16ClN3S
InChI InChI=1S/C23H16ClN3S/c24-14-9-11-15(12-10-14)27-13-20(25-26-27)23-21-16-5-1-3-7-18(16)22(28-23)19-8-4-2-6-17(19)21/h1-13,21-23H/t21-,22+,23?
InChIKey SLZJNBDGCJSPGD-AIZNXBIQSA-N
Literature Reference Author G.LABBE,M.VERBEKE,W.DEHAEN,S.TOPPET
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1719(1993)
Literature Reference DOI 10.1039/p19930001719
Molecular Weight 401.913 g/mol
Solvent CDCl3
Source File Reference UWCP6802