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DIETHYL-5,5-DICYANO-4,6-DIMETHYL-2-PHENYL-CYCLOHEXA-3,6-DIENE-1,3-CARBOXYLATE
SpectraBase Compound ID GDafEYvZiRn
InChI InChI=1S/C22H22N2O4/c1-5-27-20(25)17-14(3)22(12-23,13-24)15(4)18(21(26)28-6-2)19(17)16-10-8-7-9-11-16/h7-11,19H,5-6H2,1-4H3
InChIKey UULGVDXDCVMIIR-UHFFFAOYSA-N
Mol Weight 378.43 g/mol
Molecular Formula C22H22N2O4
Exact Mass 378.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7XRoLiOMIPo
Name DIETHYL-5,5-DICYANO-4,6-DIMETHYL-2-PHENYL-CYCLOHEXA-3,6-DIENE-1,3-CARBOXYLATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22N2O4
InChI InChI=1S/C22H22N2O4/c1-5-27-20(25)17-14(3)22(12-23,13-24)15(4)18(21(26)28-6-2)19(17)16-10-8-7-9-11-16/h7-11,19H,5-6H2,1-4H3
InChIKey UULGVDXDCVMIIR-UHFFFAOYSA-N
Literature Reference Author N.M.H.ELNAGDI,N.S.A.HOKBANY
Literature Reference Citation MOLECULES,17,4300(2012)
Literature Reference DOI 10.3390/molecules17044300
Molecular Weight 378.428 g/mol
Sample ID 1727
Solvent DMSO-D6