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5-Trifluoromethyl-3-(2-oxo-2H-[1]benzopyran-4-yl)-1,2-4-oxadiazole
SpectraBase Compound ID 3GStNOP3wLi
InChI InChI=1S/C12H5F3N2O3/c13-12(14,15)11-16-10(17-20-11)7-5-9(18)19-8-4-2-1-3-6(7)8/h1-5H
InChIKey MXTDSCWDGBWEIQ-UHFFFAOYSA-N
Mol Weight 282.18 g/mol
Molecular Formula C12H5F3N2O3
Exact Mass 282.025227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pJWReMg25y
Name 5-Trifluoromethyl-3-(2-oxo-2H-[1]benzopyran-4-yl)-1,2-4-oxadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H5F3N2O3
InChI InChI=1S/C12H5F3N2O3/c13-12(14,15)11-16-10(17-20-11)7-5-9(18)19-8-4-2-1-3-6(7)8/h1-5H
InChIKey MXTDSCWDGBWEIQ-UHFFFAOYSA-N
Molecular Weight 282.178 g/mol
SMILES c1(nc(C=2c3c(cccc3)OC(C2)=O)no1)C(F)(F)F
SPLASH splash10-0f89-0190000000-f616faa0bd82febec2c1
Source of Spectrum EMC-9-721-9c
Synonyms 4-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)-2H-chromen-2-one 4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-1-benzopyran-2-one 4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]chromen-2-one
Wiley ID 1734316