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(5E)-5-[(Butylamino)methylene]-1-(2-methylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID IvRx0uWaDAP
InChI InChI=1S/C16H19N3O3/c1-3-4-9-17-10-12-14(20)18-16(22)19(15(12)21)13-8-6-5-7-11(13)2/h5-8,10,17H,3-4,9H2,1-2H3,(H,18,20,22)/b12-10+
InChIKey GROYBSBVXFDCIO-ZRDIBKRKSA-N
Mol Weight 301.35 g/mol
Molecular Formula C16H19N3O3
Exact Mass 301.142641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2MIq9df0Sm
Name (5E)-5-[(Butylamino)methylene]-1-(2-methylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Alternate Name(s) (5E)-5-(butylaminomethylene)-1-(o-tolyl)barbituric acid (5E)-5-(butylaminomethylene)-1-(o-tolyl)hexahydropyrimidine-2,4,6-trione (5E)-5-(butylaminomethylidene)-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione Pyrimidine-2,4,6(1H,3H,5H)-trione, 5-butylaminomethylene-1-(2-methylphenyl)-
CAS Registry Number 346612-13-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19N3O3
InChI InChI=1S/C16H19N3O3/c1-3-4-9-17-10-12-14(20)18-16(22)19(15(12)21)13-8-6-5-7-11(13)2/h5-8,10,17H,3-4,9H2,1-2H3,(H,18,20,22)/b12-10+
InChIKey GROYBSBVXFDCIO-ZRDIBKRKSA-N
Molecular Weight 301.346 g/mol
SMILES N1C(\C(=C/NCCCC)C(N(C1=O)c1c(C)cccc1)=O)=O
SPLASH splash10-0ul0-8694000000-2815f8e1ec094685f0d9
Source of Spectrum AD-0-2532-0
Wiley ID 1428915