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ethyl (E)-3-fluoro-2,5-diphenylpent-2-en-4-ynoate
SpectraBase Compound ID HRiOlmWoPYm
InChI InChI=1S/C19H15FO2/c1-2-22-19(21)18(16-11-7-4-8-12-16)17(20)14-13-15-9-5-3-6-10-15/h3-12H,2H2,1H3/b18-17+
InChIKey AYRVKURLRPETAG-ISLYRVAYSA-N
Mol Weight 294.33 g/mol
Molecular Formula C19H15FO2
Exact Mass 294.105608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXTd6A4uytr
Name ethyl (E)-3-fluoro-2,5-diphenylpent-2-en-4-ynoate
Appearance Brown oil
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Formula C19H15FO2
InChI InChI=1S/C19H15FO2/c1-2-22-19(21)18(16-11-7-4-8-12-16)17(20)14-13-15-9-5-3-6-10-15/h3-12H,2H2,1H3/b18-17+
InChIKey AYRVKURLRPETAG-ISLYRVAYSA-N
Instrument Name Shimadzu GCMSQP2010 SE
Ionization Type EI
Literature Reference DOI 10.1002/anie.202002219
Molecular Weight 294.325 g/mol
Reported Formula C19H15FO2
SMILES C(\C(=C/(C#Cc1ccccc1)F)c1ccccc1)(OCC)=O
SPLASH splash10-00xu-0290000000-9d529036f0f093a5a858
Source of Spectrum ACI-59-SM11-(E)-3a
Thin-Layer Chromatography Rf = 0.29 (hexane/EA, 25:1)
Wiley ID 1858093