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3,3-DIMETHOXY-4,4-DICYANO-5-METHOXYCARBONYL-CYCLOHEXENE
SpectraBase Compound ID 9ZgxfTKnyHJ
InChI InChI=1S/C12H14N2O4/c1-16-10(15)9-5-4-6-12(17-2,18-3)11(9,7-13)8-14/h4,6,9H,5H2,1-3H3/t9-/m0/s1
InChIKey RJWYFDKECJYBMM-VIFPVBQESA-N
Mol Weight 250.25 g/mol
Molecular Formula C12H14N2O4
Exact Mass 250.095357 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 191LcTI0ccf
Name 3,3-DIMETHOXY-4,4-DICYANO-5-METHOXYCARBONYL-CYCLOHEXENE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N2O4
InChI InChI=1S/C12H14N2O4/c1-16-10(15)9-5-4-6-12(17-2,18-3)11(9,7-13)8-14/h4,6,9H,5H2,1-3H3/t9-/m0/s1
InChIKey RJWYFDKECJYBMM-VIFPVBQESA-N
Literature Reference Author R.SUSTMANN,S.TAPPANCHAI,H.BANDMANN
Literature Reference Citation J.AM.CHEM.SOC.,118,12555(1996)
Literature Reference DOI 10.1021/ja961390l
Molecular Weight 250.254 g/mol
Sample ID 35549
Solvent CDCl3