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7-(diethylamino)-3-[2-(trifluoromethyl)phenyl]chromen-2-one
SpectraBase Compound ID 5onXwbmahXf
InChI InChI=1S/C20H18F3NO2/c1-3-24(4-2)14-10-9-13-11-16(19(25)26-18(13)12-14)15-7-5-6-8-17(15)20(21,22)23/h5-12H,3-4H2,1-2H3
InChIKey IOLKXWSZBDJRRU-UHFFFAOYSA-N
Mol Weight 361.36 g/mol
Molecular Formula C20H18F3NO2
Exact Mass 361.128963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtnVJLIsqCg
Name 7-(diethylamino)-3-[2-(trifluoromethyl)phenyl]chromen-2-one
Appearance Yellowish solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 361.128963311 u
Formula C20H18F3NO2
InChI InChI=1S/C20H18F3NO2/c1-3-24(4-2)14-10-9-13-11-16(19(25)26-18(13)12-14)15-7-5-6-8-17(15)20(21,22)23/h5-12H,3-4H2,1-2H3
InChIKey IOLKXWSZBDJRRU-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo302778d
Molecular Weight 361.364 g/mol
Quality 217
SMILES C1=CC2=C(C=C1N(CC)CC)OC(C(=C2)C1=CC=CC=C1C(F)(F)F)=O
SPLASH splash10-01ot-0209000000-7e77f1b293bdb36a2ccc
Source of Spectrum JOC-78-2961-3k (DOI: 10.1021/jo302778d)
Wiley ID 1912455