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3-(2-(2,4-Dichlorobenzylidene)hydrazinyl)-7,8-dihydrobenzo[f]pyrimido[4,5-c] isoquinolin-1(2H)-one
SpectraBase Compound ID 9WqUp6wIfmL
InChI InChI=1S/C22H15Cl2N5O/c23-15-8-7-13(17(24)9-15)11-26-29-22-27-20-19(21(30)28-22)18-14(10-25-20)6-5-12-3-1-2-4-16(12)18/h1-4,7-11H,5-6H2,(H2,25,27,28,29,30)
InChIKey MPWQBDHWTJGXOS-UHFFFAOYSA-N
Mol Weight 436.3 g/mol
Molecular Formula C22H15Cl2N5O
Exact Mass 435.065366 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DiOmPZQuXvO
Name 3-(2-(2,4-Dichlorobenzylidene)hydrazinyl)-7,8-dihydrobenzo[f]pyrimido[4,5-c] isoquinolin-1(2H)-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15Cl2N5O
InChI InChI=1S/C22H15Cl2N5O/c23-15-8-7-13(17(24)9-15)11-26-29-22-27-20-19(21(30)28-22)18-14(10-25-20)6-5-12-3-1-2-4-16(12)18/h1-4,7-11H,5-6H2,(H2,25,27,28,29,30)
InChIKey MPWQBDHWTJGXOS-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-Q1000-EX & GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2632
Molecular Weight 436.302 g/mol
SMILES N1C(c2c(N=C1NN=Cc1ccc(cc1Cl)Cl)ncc1CCc3ccccc3-c21)=O
SPLASH splash10-0006-3190500000-dbc735a623970802c214
Source of Spectrum Y-54-615-13e
Wiley ID 1877915