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3-([1,1'-Biphenyl]-4-yl)cyclohexan-1-one
SpectraBase Compound ID AdWRv6fXnDO
InChI InChI=1S/C18H18O/c19-18-8-4-7-17(13-18)16-11-9-15(10-12-16)14-5-2-1-3-6-14/h1-3,5-6,9-12,17H,4,7-8,13H2
InChIKey PHMNEQQEHAHWCB-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C18H18O
Exact Mass 250.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BX0vUkLmRJx
Name 3-([1,1'-Biphenyl]-4-yl)cyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O
InChI InChI=1S/C18H18O/c19-18-8-4-7-17(13-18)16-11-9-15(10-12-16)14-5-2-1-3-6-14/h1-3,5-6,9-12,17H,4,7-8,13H2
InChIKey PHMNEQQEHAHWCB-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5SC01636C
Molecular Weight 250.341 g/mol
SMILES C1(CC(CCC1)c1ccc(cc1)-c1ccccc1)=O
SPLASH splash10-0udl-0940000000-2a06a8265f3f848493f1
Source of Spectrum CSS-6-5491/SM19-3i
Wiley ID 1801055