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1-(3-Allylbicyclo[1.1.1]pentan-1-yl)-3-cyclohexylpropan-2-one
SpectraBase Compound ID 2n96zHL2hvD
InChI InChI=1S/C17H26O/c1-2-8-16-11-17(12-16,13-16)10-15(18)9-14-6-4-3-5-7-14/h2,14H,1,3-13H2
InChIKey YZYBIYOZRXFULY-UHFFFAOYSA-N
Mol Weight 246.39 g/mol
Molecular Formula C17H26O
Exact Mass 246.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25YXe7ghmQl
Name 1-(3-Allylbicyclo[1.1.1]pentan-1-yl)-3-cyclohexylpropan-2-one
Appearance Colorless liquid
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Formula C17H26O
InChI InChI=1S/C17H26O/c1-2-8-16-11-17(12-16,13-16)10-15(18)9-14-6-4-3-5-7-14/h2,14H,1,3-13H2
InChIKey YZYBIYOZRXFULY-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202009340
Molecular Weight 246.394 g/mol
Reported Formula C17H26O
SMILES C1CCC(CC1)CC(=O)CC12CC(C2)(C1)CC=C
SPLASH splash10-0002-9100000000-63b494fe2b02e9c6d425
Source of Spectrum ACI-59-SM34-14f
Wiley ID 1858366