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BIS-[2-(3-META-CHLOROPHENYL-5-ETHOXYCARBONYL-1,3,4-THIADIAZOL-2-YLIDENEAMINO)-PHENYL]-DISULFIDE
SpectraBase Compound ID 6m77qUIYoIL
InChI InChI=1S/C34H26Cl2N6O4S4/c1-3-45-31(43)29-39-41(23-13-9-11-21(35)19-23)33(47-29)37-25-15-5-7-17-27(25)49-50-28-18-8-6-16-26(28)38-34-42(24-14-10-12-22(36)20-24)40-30(48-34)32(44)46-4-2/h5-20H,3-4H2,1-2H3/b37-33-,38-34-
InChIKey YDEODJYUDNOURN-ZHTVLWRQSA-N
Mol Weight 781.8 g/mol
Molecular Formula C34H26Cl2N6O4S4
Exact Mass 780.027543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6f4cupACj9t
Name BIS-[2-(3-META-CHLOROPHENYL-5-ETHOXYCARBONYL-1,3,4-THIADIAZOL-2-YLIDENEAMINO)-PHENYL]-DISULFIDE
Compound Number III-G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H26Cl2N6O4S4
InChI InChI=1S/C34H26Cl2N6O4S4/c1-3-45-31(43)29-39-41(23-13-9-11-21(35)19-23)33(47-29)37-25-15-5-7-17-27(25)49-50-28-18-8-6-16-26(28)38-34-42(24-14-10-12-22(36)20-24)40-30(48-34)32(44)46-4-2/h5-20H,3-4H2,1-2H3/b37-33-,38-34-
InChIKey YDEODJYUDNOURN-ZHTVLWRQSA-N
Literature Reference Author O.V.FIRSOVA,T.S.DOLGUSHINA,V.A.POLUKEEV,V.E.ZAVODNIK,A.I.STA SH,V.K.BELSKII,V.A.G
Literature Reference Citation RUSS.J.ORG.CHEM.,40,1018(2004)
Literature Reference DOI 10.1023/B:RUJO.0000045197.43364.1d
Molecular Weight 781.764 g/mol
Solvent DMSO-D6
Source File Reference UWMZ16456