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2-(3-Benzoylbicyclo[1.1.1]pentan-1-yl)cyclohexan-1-one
SpectraBase Compound ID HJGkewAg8WJ
InChI InChI=1S/C18H20O2/c19-15-9-5-4-8-14(15)17-10-18(11-17,12-17)16(20)13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2
InChIKey LBBLCFMYKMDNPI-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DR8HmOrZnji
Name 2-(3-Benzoylbicyclo[1.1.1]pentan-1-yl)cyclohexan-1-one
Appearance Colorless solid
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Formula C18H20O2
InChI InChI=1S/C18H20O2/c19-15-9-5-4-8-14(15)17-10-18(11-17,12-17)16(20)13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2
InChIKey LBBLCFMYKMDNPI-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202009340
Molecular Weight 268.356 g/mol
Reported Formula C18H20O2
SMILES C1C(C(CCC1)C12CC(C2)(C1)C(c1ccccc1)=O)=O
SPLASH splash10-0ab9-2900000000-6e66bc5d9035a263856c
Source of Spectrum ACI-59-SM33-14d
Wiley ID 1858365