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5,6-EPOXY-2,5-DIMETHYL-3-THIA-2-HEXANOATE
SpectraBase Compound ID Ktkw0YwP1cD
InChI InChI=1S/C7H12O3S/c1-7(4-10-7)5-11-3-6(8)9-2/h3-5H2,1-2H3
InChIKey AZMPLERIERLGLQ-UHFFFAOYSA-N
Mol Weight 176.23 g/mol
Molecular Formula C7H12O3S
Exact Mass 176.050715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3OhJorx4DuW
Name 5,6-EPOXY-2,5-DIMETHYL-3-THIA-2-HEXANOATE
Compound Number 2 C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O3S
InChI InChI=1S/C7H12O3S/c1-7(4-10-7)5-11-3-6(8)9-2/h3-5H2,1-2H3
InChIKey AZMPLERIERLGLQ-UHFFFAOYSA-N
Literature Reference Author M.J.BOURGEOIS,M.VIALEMARINGE,M.CAMPAGNOLE,E.MONTAUDON
Literature Reference Citation CAN.J.CHEM.,79,257(2001)
Literature Reference DOI 10.1139/cjc-79-3-257
Molecular Weight 176.230 g/mol
Solvent CDCl3
Source File Reference UWSI16044