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3-Cyano-2-phenyl-1-(4-oxo-2-trifluoromethyl-3,4-dihydroquinazolin-3-yl)aziridin
SpectraBase Compound ID 6xTYT6ds7af
InChI InChI=1S/C18H11F3N4O/c19-18(20,21)17-23-13-9-5-4-8-12(13)16(26)25(17)24-14(10-22)15(24)11-6-2-1-3-7-11/h1-9,14-15H
InChIKey NPCIBXIGQRVPRR-UHFFFAOYSA-N
Mol Weight 356.31 g/mol
Molecular Formula C18H11F3N4O
Exact Mass 356.088495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4n9genaUJu9
Name 3-Cyano-2-phenyl-1-(4-oxo-2-trifluoromethyl-3,4-dihydroquinazolin-3-yl)aziridin
Alternate Name(s) 1-(4-oxo-2-(trifluoromethyl)-3(4H)-quinazolinyl)-3-phenyl-2-aziridinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11F3N4O
InChI InChI=1S/C18H11F3N4O/c19-18(20,21)17-23-13-9-5-4-8-12(13)16(26)25(17)24-14(10-22)15(24)11-6-2-1-3-7-11/h1-9,14-15H
InChIKey NPCIBXIGQRVPRR-UHFFFAOYSA-N
Molecular Weight 356.308 g/mol
SMILES C1(N(C1C#N)N1C(=Nc2c(C1=O)cccc2)C(F)(F)F)c1ccccc1
SPLASH splash10-00kf-1900000000-85634d4c9fd68aaf1f45
Source of Spectrum KC-0-162-15
Wiley ID 785008