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4-(2,4-Dimethylphenyl)-3-[4-(trifluoromethyl)-3-pyridinyl]-1,2,4-oxadiazol-5(4H)-one
SpectraBase Compound ID Gcjx5uWpw1J
InChI InChI=1S/C16H12F3N3O2/c1-9-3-4-13(10(2)7-9)22-14(21-24-15(22)23)11-8-20-6-5-12(11)16(17,18)19/h3-8H,1-2H3
InChIKey DADBLABXFYXGKI-UHFFFAOYSA-N
Mol Weight 335.29 g/mol
Molecular Formula C16H12F3N3O2
Exact Mass 335.088161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SmutsLjM3l
Name 4-(2,4-Dimethylphenyl)-3-[4-(trifluoromethyl)-3-pyridinyl]-1,2,4-oxadiazol-5(4H)-one
CAS Registry Number 288247-11-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12F3N3O2
InChI InChI=1S/C16H12F3N3O2/c1-9-3-4-13(10(2)7-9)22-14(21-24-15(22)23)11-8-20-6-5-12(11)16(17,18)19/h3-8H,1-2H3
InChIKey DADBLABXFYXGKI-UHFFFAOYSA-N
Molecular Weight 335.286 g/mol
SMILES Cc1ccc(N2C(=NOC2=O)c2c(C(F)(F)F)ccnc2)c(c1)C
SPLASH splash10-014i-6911000000-8874c5eee968a1be4721
Source of Spectrum AD-0-2532-0
Synonyms 1,2,4-Oxadiazol-5(4H)-one, 3-[4-(trifluoromethyl)-3-pyridyl]-4-(2,4-dimethylphenyl)-] 4-(2,4-dimethylphenyl)-3-[4-(trifluoromethyl)-3-pyridinyl]-1,2,4-oxadiazol-5-one 4-(2,4-dimethylphenyl)-3-[4-(trifluoromethyl)-3-pyridyl]-1,2,4-oxadiazol-5-one 4-(2,4-dimethylphenyl)-3-[4-(trifluoromethyl)pyridin-3-yl]-1,2,4-oxadiazol-5-one
Wiley ID 1428370