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(1R,5S)-2-[(E)-3,3-dimethylbut-1-enyl]-7,7-dimethylbicyclo[3.1.1]hept-2-en-4-one

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(1R,5S)-2-[(E)-3,3-dimethylbut-1-enyl]-7,7-dimethylbicyclo[3.1.1]hept-2-en-4-one
SpectraBase Compound ID G4KgioPTSzx
InChI InChI=1S/C15H22O/c1-14(2,3)7-6-10-8-13(16)12-9-11(10)15(12,4)5/h6-8,11-12H,9H2,1-5H3/b7-6+/t11-,12+/m0/s1
InChIKey IJCIDGNTJDTULQ-FNSAGKMKSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7d12VW62iQC
Name (1R,5S)-2-[(E)-3,3-dimethylbut-1-enyl]-7,7-dimethylbicyclo[3.1.1]hept-2-en-4-one
Compound Number 5K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-14(2,3)7-6-10-8-13(16)12-9-11(10)15(12,4)5/h6-8,11-12H,9H2,1-5H3/b7-6+/t11-,12+/m0/s1
InChIKey IJCIDGNTJDTULQ-FNSAGKMKSA-N
Literature Reference Author T.M.NGUYEN,I.A.GUZEI,D.LEE
Literature Reference Citation J.ORG.CHEM.,67,6553(2002)
Literature Reference DOI 10.1021/jo025630t
Molecular Weight 218.339 g/mol
Solvent CDCl3
Source File Reference UWSI22039