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(E)-2-(2,4,5-Trifluoro-3-(2-methoxy-4-(prop-1-enyl)phenoxy)-6-(pyridin-2-yl)phenyl)benzoxazole

View entire compound with spectra: 1 MS (GC)

(E)-2-(2,4,5-Trifluoro-3-(2-methoxy-4-(prop-1-enyl)phenoxy)-6-(pyridin-2-yl)phenyl)benzoxazole
SpectraBase Compound ID KTtO8blOIuD
InChI InChI=1S/C28H19F3N2O3/c1-3-8-16-12-13-20(21(15-16)34-2)35-27-25(30)23(28-33-17-9-4-5-11-19(17)36-28)22(24(29)26(27)31)18-10-6-7-14-32-18/h3-15H,1-2H3/b8-3+
InChIKey QQIFXHNUWRSYAB-FPYGCLRLSA-N
Mol Weight 488.47 g/mol
Molecular Formula C28H19F3N2O3
Exact Mass 488.134777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IF80GcjlQn2
Name (E)-2-(2,4,5-Trifluoro-3-(2-methoxy-4-(prop-1-enyl)phenoxy)-6-(pyridin-2-yl)phenyl)benzoxazole
Alternate Name(s) (E)-2-(2,4,5-trifluoro-3-(2-methoxy-4-(prop-1-en-1-yl)phenoxy)-6-(pyridin-2-yl)phenyl)benzo[d]oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H19F3N2O3
InChI InChI=1S/C28H19F3N2O3/c1-3-8-16-12-13-20(21(15-16)34-2)35-27-25(30)23(28-33-17-9-4-5-11-19(17)36-28)22(24(29)26(27)31)18-10-6-7-14-32-18/h3-15H,1-2H3/b8-3+
InChIKey QQIFXHNUWRSYAB-FPYGCLRLSA-N
Literature Reference DOI 10.1021/ol303567t
Molecular Weight 488.466 g/mol
SMILES c1(F)c(F)c(c(-c2nc3c(o2)cccc3)c(F)c1Oc1ccc(cc1OC)\C=C\C)-c1ncccc1
SPLASH splash10-0a4r-7000900000-24aed0c32ea0be8df4bd
Source of Spectrum A1-15-940/SMS35-Table1,3p
Wiley ID 1748356