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(1R*,2S*,9R*,10R*)-BICYCLO-[7.1.0]-2-CYANO-3,3,6,10-TETRAMETHYL-(5E)-DECENE-1-CARBOXYLIC-ACID;MINOR-ISOMER
SpectraBase Compound ID 3CQHZOzLwuI
InChI InChI=1S/C16H23NO2/c1-10-5-6-11-13(16(11,4)14(18)19)12(9-17)15(2,3)8-7-10/h7,11-13H,5-6,8H2,1-4H3,(H,18,19)/b10-7+/t11-,12-,13-,16-/m1/s1
InChIKey WMZVWHQHSZILKN-OIQBDGRTSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HC5Hn1pawtk
Name (1R*,2S*,9R*,10R*)-BICYCLO-[7.1.0]-2-CYANO-3,3,6,10-TETRAMETHYL-(5E)-DECENE-1-CARBOXYLIC-ACID;MINOR-ISOMER
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-10-5-6-11-13(16(11,4)14(18)19)12(9-17)15(2,3)8-7-10/h7,11-13H,5-6,8H2,1-4H3,(H,18,19)/b10-7+/t11-,12-,13-,16-/m1/s1
InChIKey WMZVWHQHSZILKN-OIQBDGRTSA-N
Literature Reference Author T.KITAYAMA,T.OKAMOTO,R.K.HILL,Y.KAWAI,S.TAKAHASHI,S.YONEMORI ,Y.YAMAMOTO,K.OHE,S.
Literature Reference Citation J.ORG.CHEM.,64,2667(1999)
Literature Reference DOI 10.1021/jo981593n
Molecular Weight 261.364 g/mol
Sample ID 58617
Solvent CDCl3:CCl4