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6-iodo-3-((5-phenyl-1,3,4-oxadiazol-2-yl)methyl)-2-(phenylamino)quinazolin-4(3H)-one
SpectraBase Compound ID GbBX47sMcoj
InChI InChI=1S/C23H16IN5O2/c24-16-11-12-19-18(13-16)22(30)29(23(26-19)25-17-9-5-2-6-10-17)14-20-27-28-21(31-20)15-7-3-1-4-8-15/h1-13H,14H2,(H,25,26)
InChIKey JZGOQXVKOXPMEQ-UHFFFAOYSA-N
Mol Weight 521.32 g/mol
Molecular Formula C23H16IN5O2
Exact Mass 521.03487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CrdRRnNssP
Name 6-iodo-3-((5-phenyl-1,3,4-oxadiazol-2-yl)methyl)-2-(phenylamino)quinazolin-4(3H)-one
Appearance Brown crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16IN5O2
InChI InChI=1S/C23H16IN5O2/c24-16-11-12-19-18(13-16)22(30)29(23(26-19)25-17-9-5-2-6-10-17)14-20-27-28-21(31-20)15-7-3-1-4-8-15/h1-13H,14H2,(H,25,26)
InChIKey JZGOQXVKOXPMEQ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2953
Molecular Weight 521.318 g/mol
SMILES N(C1=Nc2c(cc(I)cc2)C(N1Cc1oc(nn1)-c1ccccc1)=O)c1ccccc1
SPLASH splash10-05fr-8063390000-929e53055db4809660de
Source of Spectrum Y-54-3338-9
Wiley ID 1878680