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4-(N-PHENYLTHIOCARBAMOYLTHIO)-BUTYRIC-ACID

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4-(N-PHENYLTHIOCARBAMOYLTHIO)-BUTYRIC-ACID
SpectraBase Compound ID InPylyON1jz
InChI InChI=1S/C11H13NO2S2/c13-10(14)7-4-8-16-11(15)12-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,15)(H,13,14)
InChIKey AQOMSMRSGCBGCK-UHFFFAOYSA-N
Mol Weight 255.35 g/mol
Molecular Formula C11H13NO2S2
Exact Mass 255.038771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7hRn4evnVqu
Name 4-(N-PHENYLTHIOCARBAMOYLTHIO)-BUTYRIC-ACID
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H13NO2S2
InChI InChI=1S/C11H13NO2S2/c13-10(14)7-4-8-16-11(15)12-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,15)(H,13,14)
InChIKey AQOMSMRSGCBGCK-UHFFFAOYSA-N
Literature Reference Author W.HANEFELD,H.SCHUETZ
Literature Reference Citation J.HETCYCL.CHEM.,36,1167(1999)
Literature Reference DOI 10.1002/jhet.5570360509
Molecular Weight 255.350 g/mol
Solvent CDCl3
Source File Reference UWSI24515