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3-Benzoylbicyclo[3.3.1]non-6-ene

View entire compound with spectra: 1 MS (GC)

3-Benzoylbicyclo[3.3.1]non-6-ene
SpectraBase Compound ID 4KfTGVdfaXc
InChI InChI=1S/C16H18O/c17-16(14-7-2-1-3-8-14)15-10-12-5-4-6-13(9-12)11-15/h1-5,7-8,12-13,15H,6,9-11H2/t12-,13+,15+/m1/s1
InChIKey ZSXKKUPEGLIVMK-IPYPFGDCSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CiZB8sb5jHD
Name 3-Benzoylbicyclo[3.3.1]non-6-ene
Alternate Name(s) 3-bicyclo[3.3.1]non-6-enyl(phenyl)methanone Bicyclo[3.3.1]non-6-en-3-yl(phenyl)methanone
CAS Registry Number 110013-24-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c17-16(14-7-2-1-3-8-14)15-10-12-5-4-6-13(9-12)11-15/h1-5,7-8,12-13,15H,6,9-11H2/t12-,13+,15+/m1/s1
InChIKey ZSXKKUPEGLIVMK-IPYPFGDCSA-N
Molecular Weight 226.319 g/mol
SMILES C1[C@@]2(C[C@@](C[C@]1(CC=C2)[H])(C(c1ccccc1)=O)[H])[H]
SPLASH splash10-0a6r-5910000000-f6f6a401c08c8b8e6519
Wiley ID 1475135