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4-(1-HYDROXY-1-METHYLPROP-2-EN-1-YL)-2,2-DIMETHYL-1,3-OXATHIOLAN-5-ONE;ISOMER-#1
SpectraBase Compound ID 1yrdCSrcxHM
InChI InChI=1S/C9H14O3S/c1-5-9(4,11)6-7(10)12-8(2,3)13-6/h5-6,11H,1H2,2-4H3/t6-,9?/m1/s1
InChIKey FZOXVTDINWMGMO-VJSCVCEBSA-N
Mol Weight 202.27 g/mol
Molecular Formula C9H14O3S
Exact Mass 202.066365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Io20qU4NipL
Name 4-(1-HYDROXY-1-METHYLPROP-2-EN-1-YL)-2,2-DIMETHYL-1,3-OXATHIOLAN-5-ONE;ISOMER-#1
CAS Registry Number 88802-51-1
Compound Number 2J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O3S
InChI InChI=1S/C9H14O3S/c1-5-9(4,11)6-7(10)12-8(2,3)13-6/h5-6,11H,1H2,2-4H3/t6-,9?/m1/s1
InChIKey FZOXVTDINWMGMO-VJSCVCEBSA-N
Literature Reference Author J.M.MCINTOSH,P.MISHRA,M.A.SIDDIQUI
Literature Reference Citation J.ORG.CHEM.,49,1036(1984)
Literature Reference DOI 10.1021/jo00180a016
Molecular Weight 202.268 g/mol
Solvent CDCl3
Source File Reference UWCS12011