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5-METHYL-4,6-DIOXO-1-AZAADAMANTAN-3-CARBONITRILE
SpectraBase Compound ID 6yJrBZeqyOM
InChI InChI=1S/C11H12N2O2/c1-10-5-13-3-7(8(10)14)2-11(4-12,6-13)9(10)15/h7H,2-3,5-6H2,1H3/t7-,10+,11-/m0/s1
InChIKey QUNQFUGFFAZRHJ-XROYCOCOSA-N
Mol Weight 204.23 g/mol
Molecular Formula C11H12N2O2
Exact Mass 204.089878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rQ12PeHAMe
Name 5-METHYL-4,6-DIOXO-1-AZAADAMANTAN-3-CARBONITRILE
CAS Registry Number 137628-78-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12N2O2
InChI InChI=1S/C11H12N2O2/c1-10-5-13-3-7(8(10)14)2-11(4-12,6-13)9(10)15/h7H,2-3,5-6H2,1H3/t7-,10+,11-/m0/s1
InChIKey QUNQFUGFFAZRHJ-XROYCOCOSA-N
Literature Reference Author N.RISCH,U.BILLERBECK,E.KRIEGER
Literature Reference Citation CHEM.BER.,125,459(1992)
Literature Reference DOI 10.1002/cber.19921250225
Molecular Weight 204.228 g/mol
Solvent CDCl3
Source File Reference UWCS7972