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2,2'-DITHIODIBENZOIC ACID, HEXAMETHYLENE ESTER
SpectraBase Compound ID GC94Wrk4aSf
InChI InChI=1S/C20H20O4S2/c21-19-15-9-3-5-11-17(15)25-26-18-12-6-4-10-16(18)20(22)24-14-8-2-1-7-13-23-19/h3-6,9-12H,1-2,7-8,13-14H2
InChIKey KJPWKMGPUWGUIC-UHFFFAOYSA-N
Mol Weight 388.5 g/mol
Molecular Formula C20H20O4S2
Exact Mass 388.080301 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K2IXrs4fIaE
Name 2,2'-DITHIODIBENZOIC ACID, HEXAMETHYLENE ESTER
Source of Sample S. E. Drewes & G. Riphagen, University of Natal, Natal, South Africa
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O4S2
InChI InChI=1S/C20H20O4S2/c21-19-15-9-3-5-11-17(15)25-26-18-12-6-4-10-16(18)20(22)24-14-8-2-1-7-13-23-19/h3-6,9-12H,1-2,7-8,13-14H2
InChIKey KJPWKMGPUWGUIC-UHFFFAOYSA-N
Melting Point 147C
Molecular Weight 388.51
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms DIBENZO/C,G//1,10,5,6/DIOXADITHIACYCLOHEXADECIN-5,14-DIONE, 7,8,9,10,- 11,12-HEXAHYDRO-, BENZOIC ACID, 2,2'-DITHIODI-, HEX METHYLENE ESTER