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3,4-DIHYDRO-3-[2-(2-METHYL-1,3-DIOXOLAN-2-YL)-ETHYL]-4H-THIOPYRAN-4-ONE
SpectraBase Compound ID 6DdbnvzNFfb
InChI InChI=1S/C11H16O3S/c1-11(13-5-6-14-11)4-2-9-8-15-7-3-10(9)12/h3,7,9H,2,4-6,8H2,1H3
InChIKey GYSIGRVVOFGZCS-UHFFFAOYSA-N
Mol Weight 228.31 g/mol
Molecular Formula C11H16O3S
Exact Mass 228.082016 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8mv5ubRaYOV
Name 3,4-DIHYDRO-3-[2-(2-METHYL-1,3-DIOXOLAN-2-YL)-ETHYL]-4H-THIOPYRAN-4-ONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H16O3S
InChI InChI=1S/C11H16O3S/c1-11(13-5-6-14-11)4-2-9-8-15-7-3-10(9)12/h3,7,9H,2,4-6,8H2,1H3
InChIKey GYSIGRVVOFGZCS-UHFFFAOYSA-N
Literature Reference Author D.E.WARD,Y.GAI
Literature Reference Citation CAN.J.CHEM.,75,681(1997)
Literature Reference DOI 10.1139/v97-082
Molecular Weight 228.306 g/mol
Solvent CDCl3
Source File Reference UWCP5010