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2,3,7-TRIMETHYL-9-(2',6',6'-TRIMETHYL-1'-CYCLOHEXEN-1'-YL)-2,4,6,8-NONATETRAENENITRILE
SpectraBase Compound ID BHPYVKL9kRD
InChI InChI=1S/C21H29N/c1-16(9-7-10-17(2)19(4)15-22)12-13-20-18(3)11-8-14-21(20,5)6/h7,9-10,12-13H,8,11,14H2,1-6H3/b10-7+,13-12+,16-9+,19-17+
InChIKey ANMKZXJBUDEALB-FPDDBDNFSA-N
Mol Weight 295.47 g/mol
Molecular Formula C21H29N
Exact Mass 295.23 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6uLAyt9qZYe
Name 2,3,7-TRIMETHYL-9-(2',6',6'-TRIMETHYL-1'-CYCLOHEXEN-1'-YL)-2,4,6,8-NONATETRAENENITRILE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H29N
InChI InChI=1S/C21H29N/c1-16(9-7-10-17(2)19(4)15-22)12-13-20-18(3)11-8-14-21(20,5)6/h7,9-10,12-13H,8,11,14H2,1-6H3/b10-7+,13-12+,16-9+,19-17+
InChIKey ANMKZXJBUDEALB-FPDDBDNFSA-N
Literature Reference Author P.J.E.VERDEGEM,M.C.F.MONNEE,J.LUGTENBURG
Literature Reference Citation J.ORG.CHEM.,66,1269(2001)
Literature Reference DOI 10.1021/jo0009595
Molecular Weight 295.468 g/mol
Solvent CDCl3
Source File Reference UWLU26141