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(E)-8-benzylidenebicyclo[2.2.2]octan-7-one
SpectraBase Compound ID 8tdhchGpFkZ
InChI InChI=1S/C15H16O/c16-15-13-8-6-12(7-9-13)14(15)10-11-4-2-1-3-5-11/h1-5,10,12-13H,6-9H2/b14-10+/t12-,13+
InChIKey KTWBBHONXLBZJI-DRCAHHLTSA-N
Mol Weight 212.29 g/mol
Molecular Formula C15H16O
Exact Mass 212.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IlnSjnwc8CZ
Name (E)-8-benzylidenebicyclo[2.2.2]octan-7-one
Classification Benzene and substituted derivatives
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 212.120115134 u
Formula C15H16O
InChI InChI=1S/C15H16O/c16-15-13-8-6-12(7-9-13)14(15)10-11-4-2-1-3-5-11/h1-5,10,12-13H,6-9H2/b14-10+/t12-,13+
InChIKey KTWBBHONXLBZJI-DRCAHHLTSA-N
Molecular Weight 212.292 g/mol
Number of Peaks 14
SMILES C1[C@]2(CC[C@@](C1)(\C(C2=O)=C/c1ccccc1)[H])[H]
SPLASH splash10-08i0-0940000000-55b12a8123c815b5ff59
Source of Spectrum FF-10-290-15 (DOI: 10.1002/ffj.2730100502)
Synonyms (1s,4s)-3-((E)-benzylidene)bicyclo[2.2.2]octan-2-one
Wiley ID 1801317