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1-ALPHA,6-ALPHA-5-OXOBICYCLO-[4.2.0]-OCTANE-7-EXO-CARBONITRILE
SpectraBase Compound ID AkFZK0jd6eI
InChI InChI=1S/C9H11NO/c10-5-7-4-6-2-1-3-8(11)9(6)7/h6-7,9H,1-4H2/t6-,7+,9-/m0/s1
InChIKey DPMWOVFMTQLNPZ-OOZYFLPDSA-N
Mol Weight 149.19 g/mol
Molecular Formula C9H11NO
Exact Mass 149.084064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L1HctBGmuoB
Name 1-ALPHA,6-ALPHA-5-OXOBICYCLO-[4.2.0]-OCTANE-7-EXO-CARBONITRILE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11NO
InChI InChI=1S/C9H11NO/c10-5-7-4-6-2-1-3-8(11)9(6)7/h6-7,9H,1-4H2/t6-,7+,9-/m0/s1
InChIKey DPMWOVFMTQLNPZ-OOZYFLPDSA-N
Literature Reference Author L.MEYER,N.ALOUANE,K.SCHMIDT,P.MARGARETHA
Literature Reference Citation CAN.J.CHEM.,81,417(2003)
Literature Reference DOI 10.1139/v03-016
Molecular Weight 149.192 g/mol
Solvent C6D6
Source File Reference UWLU29996