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JMKSQPHJYIHKQU-UHFFFAOYSA-N

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JMKSQPHJYIHKQU-UHFFFAOYSA-N
SpectraBase Compound ID 4KYB9f9rqV6
InChI InChI=1S/C6H8O3S/c1-4-5(6(7)8)10-3-2-9-4/h2-3H2,1H3,(H,7,8)
InChIKey JMKSQPHJYIHKQU-UHFFFAOYSA-N
Mol Weight 160.19 g/mol
Molecular Formula C6H8O3S
Exact Mass 160.019415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4EoroBmTy9Y
Name 5,6-DIHYDRO-2-METHYL-1,4-OXATHIIN-3-CARBOXYLIC ACID
Source of Sample M. J. Mcglinchey, B. G. Sayer, F. I. Onuska J. Chem. Soc. Perkin Trans. Ii, 1978, 1267
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O3S
InChI InChI=1S/C6H8O3S/c1-4-5(6(7)8)10-3-2-9-4/h2-3H2,1H3,(H,7,8)
InChIKey JMKSQPHJYIHKQU-UHFFFAOYSA-N
Molecular Weight 160.19
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=305 K Spectrometer= Bruker WH-90
Synonyms 1,4-OXATHIIN-3-CARBOXYLIC ACID, 5,6-DIHYDRO-2-METHYL-,