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1-[(1S*,2R*,3R*,4S*)-3-PHENYL-BICYCLO-[2.2.2]-OCT-5-EN-2-YL]-ETHANONE;ENDO-ISOMER
SpectraBase Compound ID Ak3HgP5PbAn
InChI InChI=1S/C16H18O/c1-11(17)15-13-7-9-14(10-8-13)16(15)12-5-3-2-4-6-12/h2-7,9,13-16H,8,10H2,1H3/t13-,14+,15-,16-/m1/s1
InChIKey SHELCCCXRYJPHE-QKPAOTATSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EjpucKMjxas
Name 1-[(1S*,2R*,3R*,4S*)-3-PHENYL-BICYCLO-[2.2.2]-OCT-5-EN-2-YL]-ETHANONE;ENDO-ISOMER
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c1-11(17)15-13-7-9-14(10-8-13)16(15)12-5-3-2-4-6-12/h2-7,9,13-16H,8,10H2,1H3/t13-,14+,15-,16-/m1/s1
InChIKey SHELCCCXRYJPHE-QKPAOTATSA-N
Literature Reference Author A.C.KINSMAN,M.A.KERR
Literature Reference Citation ORG.LETTERS,2,3517(2000)
Literature Reference DOI 10.1021/ol0065773
Molecular Weight 226.318 g/mol
Solvent CDCl3
Source File Reference UWVN30562