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thioacetic acid, S-ethyl ester
SpectraBase Compound ID CfCwG5amyjl
InChI InChI=1S/C4H8OS/c1-3-6-4(2)5/h3H2,1-2H3
InChIKey APTGPWJUOYMUCE-UHFFFAOYSA-N
Mol Weight 104.17 g/mol
Molecular Formula C4H8OS
Exact Mass 104.029586 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LiYdHNT4gDZ
Name Thioacetic acid, S-ethyl ester
CAS Registry Number 625-60-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H8OS
InChI InChI=1S/C4H8OS/c1-3-6-4(2)5/h3H2,1-2H3
InChIKey APTGPWJUOYMUCE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference C.M. Hall, J. Wemple, J. Org. Chem. 42, 2118 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3