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[2S-(2-ALPHA-(S*)-3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURAN-2-YL)-OXY]-DODECANITRILE

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[2S-(2-ALPHA-(S*)-3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURAN-2-YL)-OXY]-DODECANITRILE
SpectraBase Compound ID CB0aNAS6wVZ
InChI InChI=1S/C24H41NO2/c1-5-6-7-8-9-10-11-12-13-18(17-25)26-21-16-19-20-14-15-24(4,22(19)27-21)23(20,2)3/h18-22H,5-16H2,1-4H3/t18?,19-,20-,21-,22-,24+/m1/s1
InChIKey MEGADWBSOYXWBI-HIKJLANFSA-N
Mol Weight 375.6 g/mol
Molecular Formula C24H41NO2
Exact Mass 375.31373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hhlz2GISaVi
Name [2S-(2-ALPHA-(S*)-3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURAN-2-YL)-OXY]-DODECANITRILE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H41NO2
InChI InChI=1S/C24H41NO2/c1-5-6-7-8-9-10-11-12-13-18(17-25)26-21-16-19-20-14-15-24(4,22(19)27-21)23(20,2)3/h18-22H,5-16H2,1-4H3/t18?,19-,20-,21-,22-,24+/m1/s1
InChIKey MEGADWBSOYXWBI-HIKJLANFSA-N
Literature Reference Author C.R.NOE,M.KNOLLMUELLER,H.KUERNER,G.STEINBAUER,H.KOBERG,P.GAE RTNER
Literature Reference Citation MH.CHEM.,122,101(1991)
Literature Reference DOI 10.1007/BF00815171
Molecular Weight 375.595 g/mol
Solvent CDCl3
Source File Reference UWCS21034