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4,4,5,5-tetracyano-3,3-dimethyl-valeric acid methyl ester
SpectraBase Compound ID 1uoDUyDPKwQ
InChI InChI=1S/C12H12N4O2/c1-11(2,4-10(17)18-3)12(7-15,8-16)9(5-13)6-14/h9H,4H2,1-3H3
InChIKey DEVVTENABDOXRE-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C12H12N4O2
Exact Mass 244.096026 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A1aUxFkkBOr
Name 4,4,5,5-tetracyano-3,3-dimethyl-valeric acid methyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12N4O2
InChI InChI=1S/C12H12N4O2/c1-11(2,4-10(17)18-3)12(7-15,8-16)9(5-13)6-14/h9H,4H2,1-3H3
InChIKey DEVVTENABDOXRE-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 244.253 g/mol
Source File Reference MHKO15807