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[2S-(2-ALPHA(R*),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YLOXY)-PROPANENITRILE

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[2S-(2-ALPHA(R*),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YLOXY)-PROPANENITRILE
SpectraBase Compound ID CRY7GgNVVMs
InChI InChI=1S/C15H23NO2/c1-9(8-16)17-12-7-10-11-5-6-15(4,13(10)18-12)14(11,2)3/h9-13H,5-7H2,1-4H3/t9?,10-,11-,12-,13-,15+/m0/s1
InChIKey HHURIXBRKKNJRI-VXFOXPAASA-N
Mol Weight 249.35 g/mol
Molecular Formula C15H23NO2
Exact Mass 249.172879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A6q2xq9NLFA
Name [2S-(2-ALPHA(S*),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YLOXY)-PROPANENITRILE
CAS Registry Number 113775-59-0
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H23NO2
InChI InChI=1S/C15H23NO2/c1-9(8-16)17-12-7-10-11-5-6-15(4,13(10)18-12)14(11,2)3/h9-13H,5-7H2,1-4H3/t9?,10-,11-,12-,13-,15+/m0/s1
InChIKey HHURIXBRKKNJRI-VXFOXPAASA-N
Literature Reference Author C.R.NOE,M.KNOLLMUELLER,G.STEINBAUER,E.JANGG,H.VOELLENKLE
Literature Reference Citation CHEM.BER.,121,1231(1988)
Literature Reference DOI 10.1002/cber.19881210705
Molecular Weight 249.353 g/mol
Solvent Unknown
Source File Reference UWGB1345