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5,7-DIMETHYL-4-(4-CHLOROPHENYL)-6-PHENYL-4,5,6,7-TETRAHYDRO-3-THIA-1,2,5-TRIAZAINDENE

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5,7-DIMETHYL-4-(4-CHLOROPHENYL)-6-PHENYL-4,5,6,7-TETRAHYDRO-3-THIA-1,2,5-TRIAZAINDENE
SpectraBase Compound ID 82SutgAOgQC
InChI InChI=1S/C19H18ClN3S/c1-12-16-19(24-22-21-16)18(14-8-10-15(20)11-9-14)23(2)17(12)13-6-4-3-5-7-13/h3-12,17-18H,1-2H3/t12-,17-,18-/m0/s1
InChIKey BPSMOKXSIRXVPM-IGNZVWTISA-N
Mol Weight 355.89 g/mol
Molecular Formula C19H18ClN3S
Exact Mass 355.090996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IfgbgsGdg6C
Name 5,7-DIMETHYL-4-(4-CHLOROPHENYL)-6-PHENYL-4,5,6,7-TETRAHYDRO-3-THIA-1,2,5-TRIAZAINDENE
Compound Number 9C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18ClN3S
InChI InChI=1S/C19H18ClN3S/c1-12-16-19(24-22-21-16)18(14-8-10-15(20)11-9-14)23(2)17(12)13-6-4-3-5-7-13/h3-12,17-18H,1-2H3/t12-,17-,18-/m0/s1
InChIKey BPSMOKXSIRXVPM-IGNZVWTISA-N
Literature Reference Author V.PADMAVATHI,T.V.R.REDDY,K.A.REDDY,D.B.REDDY
Literature Reference Citation J.HETCYCL.CHEM.,40,149(2003)
Literature Reference DOI 10.1002/jhet.5570400120
Molecular Weight 355.885 g/mol
Solvent CDCl3
Source File Reference UWMS22344