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3-(benzylideneamino)-6-iodo-2-(phenylamino)quinazolin-4(3H)-one
SpectraBase Compound ID HDF69uBSCQL
InChI InChI=1S/C21H15IN4O/c22-16-11-12-19-18(13-16)20(27)26(23-14-15-7-3-1-4-8-15)21(25-19)24-17-9-5-2-6-10-17/h1-14H,(H,24,25)
InChIKey VZYOQCWYWIQJFJ-UHFFFAOYSA-N
Mol Weight 466.28 g/mol
Molecular Formula C21H15IN4O
Exact Mass 466.029056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fWvo4QociS
Name 3-(benzylideneamino)-6-iodo-2-(phenylamino)quinazolin-4(3H)-one
Appearance Brown crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15IN4O
InChI InChI=1S/C21H15IN4O/c22-16-11-12-19-18(13-16)20(27)26(23-14-15-7-3-1-4-8-15)21(25-19)24-17-9-5-2-6-10-17/h1-14H,(H,24,25)
InChIKey VZYOQCWYWIQJFJ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2953
Molecular Weight 466.282 g/mol
SMILES N(C=1N(N=Cc2ccccc2)C(c2c(N1)ccc(c2)I)=O)c1ccccc1
SPLASH splash10-1009-2222900000-2860688fc2f9bc78da47
Source of Spectrum Y-54-3339-16
Wiley ID 1878670