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1-[3-Allyl-(1,1'-biphenyl)-4-yl]ethan-1-one
SpectraBase Compound ID 8enXBpe3Rck
InChI InChI=1S/C17H16O/c1-3-7-16-12-15(10-11-17(16)13(2)18)14-8-5-4-6-9-14/h3-6,8-12H,1,7H2,2H3
InChIKey OVOINKHRFKTBHM-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C17H16O
Exact Mass 236.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZoj9roc08O
Name 1-[3-Allyl-(1,1'-biphenyl)-4-yl]ethan-1-one
Appearance Colorless oil
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Exact Mass 236.120115134 u
Formula C17H16O
InChI InChI=1S/C17H16O/c1-3-7-16-12-15(10-11-17(16)13(2)18)14-8-5-4-6-9-14/h3-6,8-12H,1,7H2,2H3
InChIKey OVOINKHRFKTBHM-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201601560
Molecular Weight 236.314 g/mol
Quality 109
Reported Formula C17H16O
SMILES C1=CC(=C(C=C1C1=CC=CC=C1)CC=C)C(=O)C
SPLASH splash10-00di-0590000000-2b7170412aa16ec7f339
Source of Spectrum ACI-55-SM7-3ea (DOI: 10.1002/anie.201601560)
Thin-Layer Chromatography 0.4 (n-hexane/EtOAc, 10:1)
Wiley ID 1904455