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4-METHYL-2,6,7-TRIOXA-1-PHOSPHABICYCLO[2.2.2] OCTANE-1-SULFIDE
SpectraBase Compound ID LKbqv1Wtmkz
InChI InChI=1S/C5H9O3PS/c1-5-2-6-9(10,7-3-5)8-4-5/h2-4H2,1H3
InChIKey OKSHJMXSMVSYAW-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C5H9O3PS
Exact Mass 180.001002 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BPyfYn80M1Y
Name 4-METHYL-2,6,7-TRIOXA-1-PHOSPHABICYCLO-[2.2.2]-OCTANE-1-SULFIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H9O3PS
InChI InChI=1S/C5H9O3PS/c1-5-2-6-9(10,7-3-5)8-4-5/h2-4H2,1H3
InChIKey OKSHJMXSMVSYAW-UHFFFAOYSA-N
Literature Reference Author J.H.KIM,M.J.GALLAGHER,R.F.TOIA
Literature Reference Citation AUSTR.J.CHEM.,47,715(1994)
Literature Reference DOI 10.1071/ch9940715
Molecular Weight 180.158 g/mol
Solvent CDCl3
Source File Reference UWRK1652