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(E)-2-(4-chlorophenyl)-5-methyl-1-phenylhex-2-en-1-one
SpectraBase Compound ID BcNqOZfdpcA
InChI InChI=1S/C19H19ClO/c1-14(2)8-13-18(15-9-11-17(20)12-10-15)19(21)16-6-4-3-5-7-16/h3-7,9-14H,8H2,1-2H3/b18-13+
InChIKey XJLLDEQPIUTTAY-QGOAFFKASA-N
Mol Weight 298.81 g/mol
Molecular Formula C19H19ClO
Exact Mass 298.112443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrcA1Rvog5K
Name (E)-2-(4-chlorophenyl)-5-methyl-1-phenylhex-2-en-1-one
Appearance Yellow oil
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Exact Mass 298.112442931 u
Formula C19H19ClO
GC Column HP-5MS (0.25 mm x 30 m, film thickness 0.25 micrometer)
GC Oven Program Oven temp 290oC or 320oC
InChI InChI=1S/C19H19ClO/c1-14(2)8-13-18(15-9-11-17(20)12-10-15)19(21)16-6-4-3-5-7-16/h3-7,9-14H,8H2,1-2H3/b18-13+
InChIKey XJLLDEQPIUTTAY-QGOAFFKASA-N
Instrument Name Agilent Technologies 7890A-Agilent 5975C VL MSD or Agilent 5975 inert
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600710
Quality 206
Reported Formula C19H19ClO
SMILES C1(Cl)=CC=C(C=C1)\C(C(=O)C1=CC=CC=C1)=C/CC(C)C
SPLASH splash10-0a4i-0951000000-394233ff905a9239d732
Source of Spectrum QE-22-SM18-3ae (DOI: 10.1002/chem.201600710)
Thin-Layer Chromatography 0.50 (pentane/EtOAc, 10:1)
Wiley ID 1903161