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BIS-[2-(5-ETHOXYCARBONYL-3-PHENYL-1,3,4-THIADIAZOL-2-YLIDENEAMINO)-PHENYL]-DISULFIDE
SpectraBase Compound ID JnOoku1w7ON
InChI InChI=1S/C34H28N6O4S4/c1-3-43-31(41)29-37-39(23-15-7-5-8-16-23)33(45-29)35-25-19-11-13-21-27(25)47-48-28-22-14-12-20-26(28)36-34-40(24-17-9-6-10-18-24)38-30(46-34)32(42)44-4-2/h5-22H,3-4H2,1-2H3/b35-33-,36-34-
InChIKey NGCZWVKFEDIZDW-SGRXOXICSA-N
Mol Weight 712.9 g/mol
Molecular Formula C34H28N6O4S4
Exact Mass 712.105488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AzLG1WC2Ymo
Name BIS-[2-(5-ETHOXYCARBONYL-3-PHENYL-1,3,4-THIADIAZOL-2-YLIDENEAMINO)-PHENYL]-DISULFIDE
Compound Number III-F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H28N6O4S4
InChI InChI=1S/C34H28N6O4S4/c1-3-43-31(41)29-37-39(23-15-7-5-8-16-23)33(45-29)35-25-19-11-13-21-27(25)47-48-28-22-14-12-20-26(28)36-34-40(24-17-9-6-10-18-24)38-30(46-34)32(42)44-4-2/h5-22H,3-4H2,1-2H3/b35-33-,36-34-
InChIKey NGCZWVKFEDIZDW-SGRXOXICSA-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 712.874 g/mol
Solvent DMSO-D6
Source File Reference UWMZ16455