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(Z)-4-(2-((4-Fluorophenyl)ethynyl)-4,5-dimethoxybenzylidene)-2-phenyloxazol-5(4H)-one
SpectraBase Compound ID KjjHfZxeN84
InChI InChI=1S/C26H18FNO4/c1-30-23-15-19(11-8-17-9-12-21(27)13-10-17)20(16-24(23)31-2)14-22-26(29)32-25(28-22)18-6-4-3-5-7-18/h3-7,9-10,12-16H,1-2H3/b22-14-
InChIKey DZKHSRTTYMGXMO-HMAPJEAMSA-N
Mol Weight 427.43 g/mol
Molecular Formula C26H18FNO4
Exact Mass 427.121986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42VRNHT5l2
Name (Z)-4-(2-((4-Fluorophenyl)ethynyl)-4,5-dimethoxybenzylidene)-2-phenyloxazol-5(4H)-one
Appearance Yellow solid
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Formula C26H18FNO4
InChI InChI=1S/C26H18FNO4/c1-30-23-15-19(11-8-17-9-12-21(27)13-10-17)20(16-24(23)31-2)14-22-26(29)32-25(28-22)18-6-4-3-5-7-18/h3-7,9-10,12-16H,1-2H3/b22-14-
InChIKey DZKHSRTTYMGXMO-HMAPJEAMSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00609
Molecular Weight 427.431 g/mol
Reported Formula C26H18FNO4
SMILES c1(F)ccc(cc1)C#Cc1c(cc(c(c1)OC)OC)\C=C\1N=C(OC1=O)c1ccccc1
SPLASH splash10-0aor-9010000000-a8434c686e8a31d5dd63
Source of Spectrum JOC-86-9366-1l
Wiley ID 1867868