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(2S)-2-ACETOXY-4-METHYL-4-PENTENENITRILE
SpectraBase Compound ID BGHw6WGK62l
InChI InChI=1S/C8H11NO2/c1-6(2)4-8(5-9)11-7(3)10/h8H,1,4H2,2-3H3/t8-/m0/s1
InChIKey LFAIVPHRVOACQE-QMMMGPOBSA-N
Mol Weight 153.18 g/mol
Molecular Formula C8H11NO2
Exact Mass 153.078979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2dNyrHBbdhv
Name (2S)-2-ACETOXY-4-METHYL-4-PENTENENITRILE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11NO2
InChI InChI=1S/C8H11NO2/c1-6(2)4-8(5-9)11-7(3)10/h8H,1,4H2,2-3H3/t8-/m0/s1
InChIKey LFAIVPHRVOACQE-QMMMGPOBSA-N
Literature Reference Author D.J.VUGTS,L.VEUM,K.AL-MAFRAJI,R.LEMMENS,R.F.SCHMITZ,F.J.J.D. KANTER,M.B.GROEN,U.
Literature Reference Citation EUR.J.ORG.CHEM.,1672(2006)
Molecular Weight 153.181 g/mol
Sample ID 43455
Solvent CDCl3