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3-Thia-hept-5-en-7-olide
SpectraBase Compound ID I74Qptonm3P
InChI InChI=1S/C6H8O2S/c7-6-5-9-4-2-1-3-8-6/h1-2H,3-5H2/b2-1-
InChIKey YPQQJVPPJAGOEP-UPHRSURJSA-N
Mol Weight 144.19 g/mol
Molecular Formula C6H8O2S
Exact Mass 144.024501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ejtYfzpn9x
Name 3-Thia-hept-5-en-7-olide
Comments 50.4 MHZ SPECTRUM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H8O2S
InChI InChI=1S/C6H8O2S/c7-6-5-9-4-2-1-3-8-6/h1-2H,3-5H2/b2-1-
InChIKey YPQQJVPPJAGOEP-UPHRSURJSA-N
Instrument Name see comment
Literature Reference S.S. Choi, G.W. Kirby, M.P. Mahajan, J. Chem. Soc. Perkin I 191 (1992).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3