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(E)-4-(2-chlorophenyl)-1-phenyl-3-(trifluoromethyl)but-3-en-1-one
SpectraBase Compound ID DbPUAj4395P
InChI InChI=1S/C17H12ClF3O/c18-15-9-5-4-8-13(15)10-14(17(19,20)21)11-16(22)12-6-2-1-3-7-12/h1-10H,11H2/b14-10+
InChIKey ZPIMAFRMNOYRKD-GXDHUFHOSA-N
Mol Weight 324.73 g/mol
Molecular Formula C17H12ClF3O
Exact Mass 324.052877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46qJErZv1Ux
Name (E)-4-(2-chlorophenyl)-1-phenyl-3-(trifluoromethyl)but-3-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClF3O
InChI InChI=1S/C17H12ClF3O/c18-15-9-5-4-8-13(15)10-14(17(19,20)21)11-16(22)12-6-2-1-3-7-12/h1-10H,11H2/b14-10+
InChIKey ZPIMAFRMNOYRKD-GXDHUFHOSA-N
Literature Reference DOI 10.1002/adsc.201200784
Molecular Weight 324.730 g/mol
SMILES c1ccc(c(\C=C\(C(F)(F)F)CC(c2ccccc2)=O)c1)Cl
SPLASH splash10-0a4i-2900000000-1c6ef3d3a2ee0c3698ee
Source of Spectrum ASC-355-n/a/SM15-27
Wiley ID 1761900