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1-(4-Chlorophenyl)-3,5-bis(4-fluorophenyl)-1,3,5-triazinan-2-one

View entire compound with spectra: 1 MS (GC)

1-(4-Chlorophenyl)-3,5-bis(4-fluorophenyl)-1,3,5-triazinan-2-one
SpectraBase Compound ID 5iEVtsozZbz
InChI InChI=1S/C21H16ClF2N3O/c22-15-1-7-19(8-2-15)26-13-25(18-9-3-16(23)4-10-18)14-27(21(26)28)20-11-5-17(24)6-12-20/h1-12H,13-14H2
InChIKey YNGUAUYMXKGAPM-UHFFFAOYSA-N
Mol Weight 399.83 g/mol
Molecular Formula C21H16ClF2N3O
Exact Mass 399.094996 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6k8iw64jFQ
Name 1-(4-Chlorophenyl)-3,5-bis(4-fluorophenyl)-1,3,5-triazinan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16ClF2N3O
InChI InChI=1S/C21H16ClF2N3O/c22-15-1-7-19(8-2-15)26-13-25(18-9-3-16(23)4-10-18)14-27(21(26)28)20-11-5-17(24)6-12-20/h1-12H,13-14H2
InChIKey YNGUAUYMXKGAPM-UHFFFAOYSA-N
Molecular Weight 399.829 g/mol
SMILES C1(N(CN(CN1c1ccc(cc1)Cl)c1ccc(cc1)F)c1ccc(cc1)F)=O
SPLASH splash10-00di-1900000000-ad8a0535c35c409a8a3b
Source of Spectrum Y-32-998-3
Wiley ID 1368936