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5-CHLORODIMETHYLAMINOMETHYLENAMINO-6-CYANO-3,4-DIPHENYLTHIENO-[2,3-C]-PYRIDAZINE
SpectraBase Compound ID 9SZKj7Q2z3
InChI InChI=1S/C22H16ClN5S/c1-28(2)22(23)25-20-16(13-24)29-21-18(20)17(14-9-5-3-6-10-14)19(26-27-21)15-11-7-4-8-12-15/h3-12H,1-2H3/b25-22+
InChIKey YBOVELHXJNNHCR-YYDJUVGSSA-N
Mol Weight 417.92 g/mol
Molecular Formula C22H16ClN5S
Exact Mass 417.081494 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KQKrpwxFJUC
Name 5-CHLORODIMETHYLAMINOMETHYLENAMINO-6-CYANO-3,4-DIPHENYLTHIENO-[2,3-C]-PYRIDAZINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H16ClN5S
InChI InChI=1S/C22H16ClN5S/c1-28(2)22(23)25-20-16(13-24)29-21-18(20)17(14-9-5-3-6-10-14)19(26-27-21)15-11-7-4-8-12-15/h3-12H,1-2H3/b25-22+
InChIKey YBOVELHXJNNHCR-YYDJUVGSSA-N
Literature Reference Author J.M.QUINTELA,M.C.VEIGA,S.CONDE,C.PEINADOR
Literature Reference Citation MH.CHEM.,127,739(1996)
Literature Reference DOI 10.1007/BF00817265
Molecular Weight 417.916 g/mol
Solvent CDCl3
Source File Reference UWMZ112