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[3-(2-phenylethynyl)phenyl]-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone
SpectraBase Compound ID DqtA5cV5N1J
InChI InChI=1S/C26H21F3N2O/c27-26(28,29)23-10-5-11-24(19-23)30-14-16-31(17-15-30)25(32)22-9-4-8-21(18-22)13-12-20-6-2-1-3-7-20/h1-11,18-19H,14-17H2
InChIKey LOMWMVFDEDHQBR-UHFFFAOYSA-N
Mol Weight 434.46 g/mol
Molecular Formula C26H21F3N2O
Exact Mass 434.160598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLQfo60XdtG
Name [3-(2-phenylethynyl)phenyl]-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21F3N2O
InChI InChI=1S/C26H21F3N2O/c27-26(28,29)23-10-5-11-24(19-23)30-14-16-31(17-15-30)25(32)22-9-4-8-21(18-22)13-12-20-6-2-1-3-7-20/h1-11,18-19H,14-17H2
InChIKey LOMWMVFDEDHQBR-UHFFFAOYSA-N
Molecular Weight 434.462 g/mol
SMILES C(N1CCN(CC1)c1cc(C(F)(F)F)ccc1)(c1cc(C#Cc2ccccc2)ccc1)=O
SPLASH splash10-0zfr-2490100000-0bab13c5ecff3662f7a6
Synonyms [3-(2-phenylethynyl)phenyl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone [3-(2-phenylethynyl)phenyl]-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone
Wiley ID 1439103