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5-{4-(Trifluoromethyl)phenyl}-2-(o-tolylethynyl)oxazole
SpectraBase Compound ID 8DZxby2jrdv
InChI InChI=1S/C19H12F3NO/c1-13-4-2-3-5-14(13)8-11-18-23-12-17(24-18)15-6-9-16(10-7-15)19(20,21)22/h2-7,9-10,12H,1H3
InChIKey DCBODIQBCKBJLI-UHFFFAOYSA-N
Mol Weight 327.31 g/mol
Molecular Formula C19H12F3NO
Exact Mass 327.087098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Arnqy7VPFAP
Name 5-{4-(Trifluoromethyl)phenyl}-2-(o-tolylethynyl)oxazole
Alternate Name(s) 2-(o-tolylethynyl)-5-(4-(trifluoromethyl)phenyl)oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12F3NO
InChI InChI=1S/C19H12F3NO/c1-13-4-2-3-5-14(13)8-11-18-23-12-17(24-18)15-6-9-16(10-7-15)19(20,21)22/h2-7,9-10,12H,1H3
InChIKey DCBODIQBCKBJLI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol300514d
Molecular Weight 327.306 g/mol
SMILES c1c(-c2ccc(cc2)C(F)(F)F)oc(C#Cc2c(cccc2)C)n1
SPLASH splash10-004i-1739000000-606f5ee9a56c81b85cf9
Source of Spectrum A1-14-1824/SMS9-5a
Wiley ID 1750175