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dithio-3-methyl-2-(3-phenyl-2-thioureido)-1-cyclopenten-1-carboxylic acid
SpectraBase Compound ID Ls0JVQv1zBO
InChI InChI=1S/C14H16N2S3/c1-9-7-8-11(13(17)18)12(9)16-14(19)15-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,17,18)(H2,15,16,19)
InChIKey OCWRRGCCQOFYJR-UHFFFAOYSA-N
Mol Weight 308.48 g/mol
Molecular Formula C14H16N2S3
Exact Mass 308.047562 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FJw26GJFJqC
Name DITHIO-3-METHYL-2-(3-PHENYL-2-THIOUREIDO)-1-CYCLOPENTENE-1-CARBOXYLIC ACID
Source of Sample T. Takeshima, Chiba University, Chiba City, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2S3
InChI InChI=1S/C14H16N2S3/c1-9-7-8-11(13(17)18)12(9)16-14(19)15-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,17,18)(H2,15,16,19)
InChIKey OCWRRGCCQOFYJR-UHFFFAOYSA-N
Literature Reference J. CHEM. SOC. PERKIN TRANS. I, 1009(1973)
Melting Point 97-98C
Molecular Weight 308.476013
Synonyms 1-CYCLOPENTENE-1-CARBOXYLIC ACID, DITHIO-3-METHYL-2-/3-PHENYL-2-THIO- UREIDO/-,
Technique KBr WAFER