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3-(2,4-CYCLOHEXADIEN-1-YL)-1,1,2,2-CYCLOPROPANTETRACARBONITRILE
SpectraBase Compound ID FslGvzc1fjc
InChI InChI=1S/C13H8N4/c14-6-12(7-15)11(13(12,8-16)9-17)10-4-2-1-3-5-10/h1-4,10-11H,5H2
InChIKey PVYRAAFGBSYKHV-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C13H8N4
Exact Mass 220.074896 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EdVY66eQRgZ
Name 3-(2,4-CYCLOHEXADIEN-1-YL)-1,1,2,2-CYCLOPROPANTETRACARBONITRILE
CAS Registry Number 96866-00-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H8N4
InChI InChI=1S/C13H8N4/c14-6-12(7-15)11(13(12,8-16)9-17)10-4-2-1-3-5-10/h1-4,10-11H,5H2
InChIKey PVYRAAFGBSYKHV-UHFFFAOYSA-N
Literature Reference Author R.LANG,C.HERZOG,R.STANGL,E.BRUNN,M.BRAUN,M.CHRISTL,E.M.PETER S,K.PETERS,H.G.VONSC
Literature Reference Citation CHEM.BER.,123,1193(1990)
Literature Reference DOI 10.1002/cber.19901230537
Molecular Weight 220.233 g/mol
Solvent ACETONE-D6
Source File Reference UWED11412