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4-ALLYL-2,2,4-TRIMETHYL-1,3-OXATHIOLAN-5-ONE
SpectraBase Compound ID 6wnaLGE97MP
InChI InChI=1S/C9H14O2S/c1-5-6-9(4)7(10)11-8(2,3)12-9/h5H,1,6H2,2-4H3/t9-/m0/s1
InChIKey HVQGWBDYAZXSGD-VIFPVBQESA-N
Mol Weight 186.27 g/mol
Molecular Formula C9H14O2S
Exact Mass 186.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bjBoU8ELIh
Name 4-ALLYL-2,2,4-TRIMETHYL-1,3-OXATHIOLAN-5-ONE
CAS Registry Number 88802-42-0
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O2S
InChI InChI=1S/C9H14O2S/c1-5-6-9(4)7(10)11-8(2,3)12-9/h5H,1,6H2,2-4H3/t9-/m0/s1
InChIKey HVQGWBDYAZXSGD-VIFPVBQESA-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 186.269 g/mol
Solvent CDCl3
Source File Reference UWCS12004