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N-[(E)-3-(4-acetylphenyl)allyl]-2,2,2-trifluoro-N-[2-(2-phenylethynyl)phenyl]acetamide
SpectraBase Compound ID 9hTvF8zpjSH
InChI InChI=1S/C27H20F3NO2/c1-20(32)23-16-13-22(14-17-23)10-7-19-31(26(33)27(28,29)30)25-12-6-5-11-24(25)18-15-21-8-3-2-4-9-21/h2-14,16-17H,19H2,1H3/b10-7+
InChIKey OFRLEPOTRLUWDN-JXMROGBWSA-N
Mol Weight 447.46 g/mol
Molecular Formula C27H20F3NO2
Exact Mass 447.144613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKYtm7xvdjv
Name N-[(E)-3-(4-acetylphenyl)allyl]-2,2,2-trifluoro-N-[2-(2-phenylethynyl)phenyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H20F3NO2
InChI InChI=1S/C27H20F3NO2/c1-20(32)23-16-13-22(14-17-23)10-7-19-31(26(33)27(28,29)30)25-12-6-5-11-24(25)18-15-21-8-3-2-4-9-21/h2-14,16-17H,19H2,1H3/b10-7+
InChIKey OFRLEPOTRLUWDN-JXMROGBWSA-N
Molecular Weight 447.457 g/mol
SMILES C(N(c1c(C#Cc2ccccc2)cccc1)C\C=C\c1ccc(C(=O)C)cc1)(C(F)(F)F)=O
SPLASH splash10-0002-0001900000-c18015d7b9cf9a74bfe3
Source of Spectrum J-63-1010-4
Synonyms N-[(E)-3-(4-acetylphenyl)prop-2-enyl]-2,2,2-trifluoro-N-[2-(2-phenylethynyl)phenyl]acetamide N-[(E)-3-(4-ethanoylphenyl)prop-2-enyl]-2,2,2-tris(fluoranyl)-N-[2-(2-phenylethynyl)phenyl]ethanamide
Wiley ID 1386957