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2,2,2-trifluoro-N-[(E)-3-(4-methoxyphenyl)allyl]-N-[2-(2-phenylethynyl)phenyl]acetamide
SpectraBase Compound ID F4LreZ0TQN5
InChI InChI=1S/C26H20F3NO2/c1-32-23-17-14-21(15-18-23)10-7-19-30(25(31)26(27,28)29)24-12-6-5-11-22(24)16-13-20-8-3-2-4-9-20/h2-12,14-15,17-18H,19H2,1H3/b10-7+
InChIKey UXOIYBNLTHTTTG-JXMROGBWSA-N
Mol Weight 435.45 g/mol
Molecular Formula C26H20F3NO2
Exact Mass 435.144613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOIOrYtUyI3
Name 2,2,2-trifluoro-N-[(E)-3-(4-methoxyphenyl)allyl]-N-[2-(2-phenylethynyl)phenyl]acetamide
Alternate Name(s) 2,2,2-trifluoro-N-[(E)-3-(4-methoxyphenyl)prop-2-enyl]-N-[2-(2-phenylethynyl)phenyl]acetamide 2,2,2-tris(fluoranyl)-N-[(E)-3-(4-methoxyphenyl)prop-2-enyl]-N-[2-(2-phenylethynyl)phenyl]ethanamide
Comments Less than 3 mono-isotopic peaks
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Formula C26H20F3NO2
InChI InChI=1S/C26H20F3NO2/c1-32-23-17-14-21(15-18-23)10-7-19-30(25(31)26(27,28)29)24-12-6-5-11-22(24)16-13-20-8-3-2-4-9-20/h2-12,14-15,17-18H,19H2,1H3/b10-7+
InChIKey UXOIYBNLTHTTTG-JXMROGBWSA-N
Molecular Weight 435.446 g/mol
SMILES C(N(c1c(C#Cc2ccccc2)cccc1)C\C=C\c1ccc(cc1)OC)(C(F)(F)F)=O
SPLASH splash10-000j-0800900000-504a9aa3475354bb1b9a
Source of Spectrum J-63-1010-4
Wiley ID 1383276