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3-METHOXY-4,4,5,5-TETRACYANO-CYCLOHEXENE

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3-METHOXY-4,4,5,5-TETRACYANO-CYCLOHEXENE
SpectraBase Compound ID Kq4RyqZp3Dc
InChI InChI=1S/C11H8N4O/c1-16-9-3-2-4-10(5-12,6-13)11(9,7-14)8-15/h2-3,9H,4H2,1H3
InChIKey LYBHUZXLDCJNBU-UHFFFAOYSA-N
Mol Weight 212.21 g/mol
Molecular Formula C11H8N4O
Exact Mass 212.069811 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KOxnqirhejA
Name 3-METHOXY-4,4,5,5-TETRACYANO-CYCLOHEXENE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H8N4O
InChI InChI=1S/C11H8N4O/c1-16-9-3-2-4-10(5-12,6-13)11(9,7-14)8-15/h2-3,9H,4H2,1H3
InChIKey LYBHUZXLDCJNBU-UHFFFAOYSA-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 212.211 g/mol
Sample ID 35569
Solvent CDCl3