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(1RS,7RS,10RS,11RS)-11CYANO-N-CYCLOHEXYL-4-METHYL-3-OXO-6,6-DIPHENYL-2-AZATETRACYCLO-[5.3.1.0(1.5).0(10,11)]-UNDECA-4,8-DIENE-2-CARBOXAMIDE
SpectraBase Compound ID lRRlUzdRST
InChI InChI=1S/C31H29N3O2/c1-20-26-30(21-11-5-2-6-12-21,22-13-7-3-8-14-22)24-17-18-25-29(24,19-32)31(25,26)34(27(20)35)28(36)33-23-15-9-4-10-16-23/h2-3,5-8,11-14,17-18,23-25H,4,9-10,15-16H2,1H3,(H,33,36)/t24-,25+,29-,31+/m1/s1
InChIKey WCSKGZXSSBBOKI-MFOYMVSRSA-N
Mol Weight 475.59 g/mol
Molecular Formula C31H29N3O2
Exact Mass 475.225977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3f1iBVX5NHB
Name (1RS,7RS,10RS,11RS)-11CYANO-N-CYCLOHEXYL-4-METHYL-3-OXO-6,6-DIPHENYL-2-AZATETRACYCLO-[5.3.1.0(1.5).0(10,11)]-UNDECA-4,8-DIENE-2-CARBOXAMIDE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H29N3O2
InChI InChI=1S/C31H29N3O2/c1-20-26-30(21-11-5-2-6-12-21,22-13-7-3-8-14-22)24-17-18-25-29(24,19-32)31(25,26)34(27(20)35)28(36)33-23-15-9-4-10-16-23/h2-3,5-8,11-14,17-18,23-25H,4,9-10,15-16H2,1H3,(H,33,36)/t24-,25+,29-,31+/m1/s1
InChIKey WCSKGZXSSBBOKI-MFOYMVSRSA-N
Literature Reference Author T.R.MIHOVA,L.S.TRIFONOV,V.S.DIMITROV,A.S.ORAHOVATS,A.LINDEN, H.HEIMGARTNER
Literature Reference Citation HELV.CHIM.ACTA,74,1011(1991)
Literature Reference DOI 10.1002/hlca.19910740512
Molecular Weight 475.590 g/mol
Solvent CDCl3
Source File Reference UWVP4959