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6,7-Difluoro-2-[(E)-2-(4-fluoro-phenyl)-vinyl]-3-phenyl-3H-quinazolin-4-one
SpectraBase Compound ID 7pLaYrsu3Lk
InChI InChI=1S/C22H13F3N2O/c23-15-9-6-14(7-10-15)8-11-21-26-20-13-19(25)18(24)12-17(20)22(28)27(21)16-4-2-1-3-5-16/h1-13H/b11-8+
InChIKey SJPPGUSKDVMSGU-DHZHZOJOSA-N
Mol Weight 378.35 g/mol
Molecular Formula C22H13F3N2O
Exact Mass 378.097998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqFDyRRpTFx
Name 6,7-Difluoro-2-[(E)-2-(4-fluoro-phenyl)-vinyl]-3-phenyl-3H-quinazolin-4-one
Alternate Name(s) trans-3-Phenyl-6,7-difluoro-2-[2-(4-fluorophenyl)vinyl]-3-quinazolin-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H13F3N2O
InChI InChI=1S/C22H13F3N2O/c23-15-9-6-14(7-10-15)8-11-21-26-20-13-19(25)18(24)12-17(20)22(28)27(21)16-4-2-1-3-5-16/h1-13H/b11-8+
InChIKey SJPPGUSKDVMSGU-DHZHZOJOSA-N
Molecular Weight 378.354 g/mol
SMILES C1(N(C(\C=C\c2ccc(cc2)F)=Nc2c1cc(c(F)c2)F)c1ccccc1)=O
SPLASH splash10-004i-0009000000-c9a9ee5b443029a733be
Source of Spectrum O1-47-759-3k
Wiley ID 1669547