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1,3-Dimethyl-5-(4-methylamino-3-nitrobenzyl)barbituric acid
SpectraBase Compound ID Hn03cLouHut
InChI InChI=1S/C14H16N4O5/c1-15-10-5-4-8(7-11(10)18(22)23)6-9-12(19)16(2)14(21)17(3)13(9)20/h4-5,7,9,15H,6H2,1-3H3
InChIKey COUNNZIRJUMISS-UHFFFAOYSA-N
Mol Weight 320.31 g/mol
Molecular Formula C14H16N4O5
Exact Mass 320.11207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pvGHcgIL6P
Name 1,3-Dimethyl-5-(4-methylamino-3-nitrobenzyl)barbituric acid
Alternate Name(s) 1,3-Dimethyl-5-[4-(methylamino)-3-nitrobenzyl]-2,4,6(1H,3H,5H)-pyrimidinetrione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N4O5
InChI InChI=1S/C14H16N4O5/c1-15-10-5-4-8(7-11(10)18(22)23)6-9-12(19)16(2)14(21)17(3)13(9)20/h4-5,7,9,15H,6H2,1-3H3
InChIKey COUNNZIRJUMISS-UHFFFAOYSA-N
Molecular Weight 320.305 g/mol
SMILES N(c1ccc(cc1N(=O)=O)CC1C(N(C(N(C)C1=O)=O)C)=O)C
SPLASH splash10-014i-0901000000-60f90717141f52f97e2a
Source of Spectrum B-29-2213-0
Wiley ID 1319768