John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=69nM1DWIZkY SpectraBase Spectrum ID=11PQsDp99Sv

(accessed ).
4,4'-(trimethylenedioxy)bis[thiobenzoic acid], O,O-diethyl ester
SpectraBase Compound ID 69nM1DWIZkY
InChI InChI=1S/C21H24O4S2/c1-3-22-20(26)16-6-10-18(11-7-16)24-14-5-15-25-19-12-8-17(9-13-19)21(27)23-4-2/h6-13H,3-5,14-15H2,1-2H3
InChIKey FHWXZVHBJYFOOX-UHFFFAOYSA-N
Mol Weight 404.54 g/mol
Molecular Formula C21H24O4S2
Exact Mass 404.111603 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 11PQsDp99Sv
Name 4,4'-(TRIMETHYLENEDIOXY)BIS[THIOBENZOIC ACID], O,O-DIETHYL ESTER
Source of Sample P. Reynaud, Faculty of Pharmacy, University of Paris, France
Copyright Copyright © 1980, 1981-2020 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O4S2
InChI InChI=1S/C21H24O4S2/c1-3-22-20(26)16-6-10-18(11-7-16)24-14-5-15-25-19-12-8-17(9-13-19)21(27)23-4-2/h6-13H,3-5,14-15H2,1-2H3
InChIKey FHWXZVHBJYFOOX-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 62, 7676(1965)
Melting Point 116C
Molecular Weight 404.539001
SpectraBase Batch ID Fok5z5rahy6
Synonyms BENZOIC ACID, 4,4PR-/TRIMETHYLENE- DIOXY/BIS/THIO-, O,O-DIETHYL ESTER
Technique KBr WAFER