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1-[2'-(Trifluoromethyl)phenyl]-5-phenyl-3-oxo-4-penten-1-yne
SpectraBase Compound ID 19iIvE5YmC6
InChI InChI=1S/C18H11F3O/c19-18(20,21)17-9-5-4-8-15(17)11-13-16(22)12-10-14-6-2-1-3-7-14/h1-10,12H/b12-10+
InChIKey XPWLIXBUCNXKTM-ZRDIBKRKSA-N
Mol Weight 300.28 g/mol
Molecular Formula C18H11F3O
Exact Mass 300.076199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kLZ0kL6X3p
Name 1-[2'-(Trifluoromethyl)phenyl]-5-phenyl-3-oxo-4-penten-1-yne
Alternate Name(s) (1E)-1-phenyl-5-[2-(trifluoromethyl)phenyl]-1-penten-4-yn-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11F3O
InChI InChI=1S/C18H11F3O/c19-18(20,21)17-9-5-4-8-15(17)11-13-16(22)12-10-14-6-2-1-3-7-14/h1-10,12H/b12-10+
InChIKey XPWLIXBUCNXKTM-ZRDIBKRKSA-N
Molecular Weight 300.280 g/mol
SMILES C(c1c(C#CC(\C=C\c2ccccc2)=O)cccc1)(F)(F)F
SPLASH splash10-0uea-0292000000-f011dbc1e3ab1aff9a85
Source of Spectrum F6-138-20-3
Wiley ID 1612240