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3-({(E)-[3-(4-chlorophenoxy)phenyl]methylidene}amino)-2-phenylquinazolin-4(3H)-one
SpectraBase Compound ID 4qLmFACR7IR
InChI InChI=1S/C27H18ClN3O2/c28-21-13-15-22(16-14-21)33-23-10-6-7-19(17-23)18-29-31-26(20-8-2-1-3-9-20)30-25-12-5-4-11-24(25)27(31)32/h1-18H/b29-18+
InChIKey DZAQGNQTYMZPIC-RDRPBHBLSA-N
Mol Weight 451.91 g/mol
Molecular Formula C27H18ClN3O2
Exact Mass 451.108755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 39PiIpdLSL8
Name 3-({(E)-[3-(4-chlorophenoxy)phenyl]methylidene}amino)-2-phenylquinazolin-4(3H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C27H18ClN3O2
InChI InChI=1S/C27H18ClN3O2/c28-21-13-15-22(16-14-21)33-23-10-6-7-19(17-23)18-29-31-26(20-8-2-1-3-9-20)30-25-12-5-4-11-24(25)27(31)32/h1-18H/b29-18+
InChIKey DZAQGNQTYMZPIC-RDRPBHBLSA-N
Molecular Weight 451.913 g/mol
SMILES C=1(N(C(c2c(N1)cccc2)=O)\N=C\c1cc(Oc2ccc(cc2)Cl)ccc1)c1ccccc1
SPLASH splash10-0udi-0000900000-77294a70833d4d2979d9
Source of Spectrum F2-46-1015-4
Wiley ID 1703505