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5,6-EPOXY-2,5-DIMETHYL-4-OXO-HEXENNITRIL;KONFORMER-1
SpectraBase Compound ID dDijAjgLua
InChI InChI=1S/C8H11NO2/c1-6(4-9)3-7(10)8(2)5-11-8/h6H,3,5H2,1-2H3
InChIKey NVEQPLBJXVBIQN-UHFFFAOYSA-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 3te5NHx4HiB
Name 5,6-EPOXY-2,5-DIMETHYL-4-OXO-HEXENNITRIL;KONFORMER-1
CAS Registry Number 121789-12-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11NO2
InChI InChI=1S/C8H11NO2/c1-6(4-9)3-7(10)8(2)5-11-8/h6H,3,5H2,1-2H3
InChIKey NVEQPLBJXVBIQN-UHFFFAOYSA-N
Literature Reference Author S.HUENIG,C.MARSCHNER
Literature Reference Citation CHEM.BER.,123,107(1990)
Literature Reference DOI 10.1002/cber.19901230122
Molecular Weight 153.181 g/mol
Solvent CDCl3
Source File Reference UWED9665