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2-(4-CHLOROPHENYL)-7-METHYLPYRAZOLO-[1,5-C]-[1,3,5]-THIADIAZINE-4-THIONE
SpectraBase Compound ID FymVw2S0gHO
InChI InChI=1S/C12H8ClN3S2/c1-7-6-10-14-11(18-12(17)16(10)15-7)8-2-4-9(13)5-3-8/h2-6H,1H3
InChIKey LBEMJMGPRUKOQE-UHFFFAOYSA-N
Mol Weight 293.79 g/mol
Molecular Formula C12H8ClN3S2
Exact Mass 292.984817 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8WQGPyH0oVH
Name 2-(4-CHLOROPHENYL)-7-METHYLPYRAZOLO-[1,5-C]-[1,3,5]-THIADIAZINE-4-THIONE
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H8ClN3S2
InChI InChI=1S/C12H8ClN3S2/c1-7-6-10-14-11(18-12(17)16(10)15-7)8-2-4-9(13)5-3-8/h2-6H,1H3
InChIKey LBEMJMGPRUKOQE-UHFFFAOYSA-N
Literature Reference Author C.B.VICENTINI,A.C.VERONESE,M.GUARNERI,M.MANFRINI,P.GIORI,S.G UCCIONE
Literature Reference Citation J.HETCYCL.CHEM.,31,1477(1994)
Literature Reference DOI 10.1002/jhet.5570310632
Molecular Weight 293.789 g/mol
Solvent CDCl3
Source File Reference UWCS19188