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6-chloro-7-methyl-3-(3-(trifluoromethyl)phenyl)-4H-chromen-4-one
SpectraBase Compound ID IjcAq03SeY9
InChI InChI=1S/C17H10ClF3O2/c1-9-5-15-12(7-14(9)18)16(22)13(8-23-15)10-3-2-4-11(6-10)17(19,20)21/h2-8H,1H3
InChIKey NZYBQOBLPLVUOQ-UHFFFAOYSA-N
Mol Weight 338.71 g/mol
Molecular Formula C17H10ClF3O2
Exact Mass 338.032142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A061ObiXBIL
Name 6-chloro-7-methyl-3-(3-(trifluoromethyl)phenyl)-4H-chromen-4-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10ClF3O2
InChI InChI=1S/C17H10ClF3O2/c1-9-5-15-12(7-14(9)18)16(22)13(8-23-15)10-3-2-4-11(6-10)17(19,20)21/h2-8H,1H3
InChIKey NZYBQOBLPLVUOQ-UHFFFAOYSA-N
Instrument Name GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200645
Molecular Weight 338.713 g/mol
SMILES c1(Cl)cc2c(cc1C)OC=C(C2=O)c1cc(ccc1)C(F)(F)F
SPLASH splash10-000i-1309000000-2a57d1307f6660a5250e
Source of Spectrum ASC-364-SM17-4j
Wiley ID 1877421