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2-Thioxo-cyclopentanecarboxylic acid, ethyl ester
SpectraBase Compound ID 71CNG4eFbYS
InChI InChI=1S/C8H12O2S/c1-2-10-8(9)6-4-3-5-7(6)11/h11H,2-5H2,1H3
InChIKey FYEYSNRFEGSEEH-UHFFFAOYSA-N
Mol Weight 172.24 g/mol
Molecular Formula C8H12O2S
Exact Mass 172.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CKY8ueb72xP
Name 2-Thioxo-cyclopentanecarboxylic acid, ethyl ester
CAS Registry Number 20632-95-5
Comments (Z)-ENETHIOL FORM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12O2S
InChI InChI=1S/C8H12O2S/c1-2-10-8(9)6-4-3-5-7(6)11/h11H,2-5H2,1H3
InChIKey FYEYSNRFEGSEEH-UHFFFAOYSA-N
Instrument Name Bruker HX-270
Literature Reference F. Duns, P.E. Hansen, Org. Magn. Resonance 22, 16 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3