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N-(4-(Trifluoromethyl)phenyl)-4-oxo-4H-1-benzopyran-3-carboxamide
SpectraBase Compound ID 7R5Frr4Y9a7
InChI InChI=1S/C17H10F3NO3/c18-17(19,20)10-5-7-11(8-6-10)21-16(23)13-9-24-14-4-2-1-3-12(14)15(13)22/h1-9H,(H,21,23)
InChIKey ICZSVZVJXCLBRZ-UHFFFAOYSA-N
Mol Weight 333.27 g/mol
Molecular Formula C17H10F3NO3
Exact Mass 333.061278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DbwRNU6udd
Name N-(4-(Trifluoromethyl)phenyl)-4-oxo-4H-1-benzopyran-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10F3NO3
InChI InChI=1S/C17H10F3NO3/c18-17(19,20)10-5-7-11(8-6-10)21-16(23)13-9-24-14-4-2-1-3-12(14)15(13)22/h1-9H,(H,21,23)
InChIKey ICZSVZVJXCLBRZ-UHFFFAOYSA-N
Instrument Name VG AutoSpec
Ionization Type EI
Literature Reference DOI 10.1021/jm2004267
Molecular Weight 333.266 g/mol
SMILES N(C(C1=COc2ccccc2C1=O)=O)c1ccc(cc1)C(F)(F)F
SPLASH splash10-00di-0903000000-9cd630a70230a085d6ae
Source of Spectrum AF-54-5171-21
Wiley ID 1851890