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(E)-8-(cyclohexylmethylene)bicyclo[2.2.2]octan-7-one
SpectraBase Compound ID IaOGjuoJje0
InChI InChI=1S/C15H22O/c16-15-13-8-6-12(7-9-13)14(15)10-11-4-2-1-3-5-11/h10-13H,1-9H2/b14-10+/t12-,13+
InChIKey GEEIBUDKKKDGMR-DRCAHHLTSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70tOJCoJcc1
Name (E)-8-(cyclohexylmethylene)bicyclo[2.2.2]octan-7-one
Classification Ketones
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 218.167065327 u
Formula C15H22O
InChI InChI=1S/C15H22O/c16-15-13-8-6-12(7-9-13)14(15)10-11-4-2-1-3-5-11/h10-13H,1-9H2/b14-10+/t12-,13+
InChIKey GEEIBUDKKKDGMR-DRCAHHLTSA-N
Molecular Weight 218.340 g/mol
Number of Peaks 14
SMILES C1[C@]2(CC[C@@](C1)(\C(C2=O)=C/C1CCCCC1)[H])[H]
SPLASH splash10-0006-3920000000-ccfdb5a4dc3237706e68
Source of Spectrum FF-10-290-20 (DOI: 10.1002/ffj.2730100502)
Synonyms (1s,4s,E)-3-(cyclohexylmethylene)bicyclo[2.2.2]octan-2-one
Wiley ID 1801322