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6-Amino-1-(2-chlorobenzyl)-5-((1-(4-nitrophenyl)ethylidene)amino)pyrimidine-2,4-dione
SpectraBase Compound ID Crzlnm3KjnQ
InChI InChI=1S/C19H16ClN5O4/c1-11(12-6-8-14(9-7-12)25(28)29)22-16-17(21)24(19(27)23-18(16)26)10-13-4-2-3-5-15(13)20/h2-9H,10,21H2,1H3,(H,23,26,27)
InChIKey NIMRCUJOMUSKOZ-UHFFFAOYSA-N
Mol Weight 413.82 g/mol
Molecular Formula C19H16ClN5O4
Exact Mass 413.089082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xqtU5oRqy
Name 6-Amino-1-(2-chlorobenzyl)-5-((1-(4-nitrophenyl)ethylidene)amino)pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.089081711 u
Formula C19H16ClN5O4
InChI InChI=1S/C19H16ClN5O4/c1-11(12-6-8-14(9-7-12)25(28)29)22-16-17(21)24(19(27)23-18(16)26)10-13-4-2-3-5-15(13)20/h2-9H,10,21H2,1H3,(H,23,26,27)
InChIKey NIMRCUJOMUSKOZ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 5050A
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2021.103669
Molecular Weight 413.821 g/mol
SMILES NC1=C(C(NC(N1CC1=C(C=CC=C1)Cl)=O)=O)N=C(C)C1=CC=C(C=C1)[N+](=O)[O-]
SPLASH splash10-000j-2395100000-e04740ced91707dc3bb2
Source of Spectrum AJC-15-12-4 (DOI: 10.1016/j.arabjc.2021.103669)
Wiley ID 1908048