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[2R-(2-ALPHA(R*),3A-ALPHA,4-ALPHA,7-ALPHA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YL)-OXY]-3-(PHENYLMETHOXY)-PROPANENITRILE

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[2R-(2-ALPHA(R*),3A-ALPHA,4-ALPHA,7-ALPHA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YL)-OXY]-3-(PHENYLMETHOXY)-PROPANENITRILE
SpectraBase Compound ID 2blnZHhQEnS
InChI InChI=1S/C22H29NO3/c1-21(2)18-9-10-22(21,3)20-17(18)11-19(26-20)25-16(12-23)14-24-13-15-7-5-4-6-8-15/h4-8,16-20H,9-11,13-14H2,1-3H3/t16?,17-,18+,19-,20-,22-/m1/s1
InChIKey BLGWHJPYMVPUJC-LFCMXAKXSA-N
Mol Weight 355.48 g/mol
Molecular Formula C22H29NO3
Exact Mass 355.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6CxJRw77JqF
Name [2R-(2-ALPHA(S*),3A-ALPHA,4-ALPHA,7-ALPHA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YL)-OXY]-3-(PHENYLMETHOXY)-PROPANENITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO3
InChI InChI=1S/C22H29NO3/c1-21(2)18-9-10-22(21,3)20-17(18)11-19(26-20)25-16(12-23)14-24-13-15-7-5-4-6-8-15/h4-8,16-20H,9-11,13-14H2,1-3H3/t16?,17-,18+,19-,20-,22-/m1/s1
InChIKey BLGWHJPYMVPUJC-LFCMXAKXSA-N
Literature Reference Author C.R.NOE,M.KNOLLMUELLER,B.OBERHAUSER,G.STEINBAUER,E.WAGNER
Literature Reference Citation CHEM.BER.,119,729(1986)
Literature Reference DOI 10.1002/cber.19861190230
Molecular Weight 355.477 g/mol
Solvent CDCl3
Source File Reference UWGB1166