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METHYL_(Z)-6-(3,4-DIHYDRO-4-OXO-2-H-THIOPYRAN-3-YL)-2-HEXENOATE
SpectraBase Compound ID DVxvcCcgSBE
InChI InChI=1S/C12H16O3S/c1-15-12(14)6-4-2-3-5-10-9-16-8-7-11(10)13/h4,6-8,10H,2-3,5,9H2,1H3/b6-4-
InChIKey ICGXGOHYINYUTJ-XQRVVYSFSA-N
Mol Weight 240.32 g/mol
Molecular Formula C12H16O3S
Exact Mass 240.082016 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9pxINuu9LWV
Name METHYL_(Z)-6-(3,4-DIHYDRO-4-OXO-2-H-THIOPYRAN-3-YL)-2-HEXENOATE
Compound Number 25A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O3S
InChI InChI=1S/C12H16O3S/c1-15-12(14)6-4-2-3-5-10-9-16-8-7-11(10)13/h4,6-8,10H,2-3,5,9H2,1H3/b6-4-
InChIKey ICGXGOHYINYUTJ-XQRVVYSFSA-N
Literature Reference Author D.E.WARD,T.E.NIXEY,Y.GAI,M.J.HRAPCHAK,M.S.ABAEE
Literature Reference Citation CAN.J.CHEM.,74,1418(1996)
Literature Reference DOI 10.1139/v96-160
Molecular Weight 240.317 g/mol
Solvent CDCl3
Source File Reference UWMZ1545