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QSELDKYOARDOCZ-UHFFFAOYSA-N
SpectraBase Compound ID GGQXhQRbXL8
InChI InChI=1S/C9H14N2O3/c1-3-4-5(2)6-7(12)10-9(14)11-8(6)13/h5-6H,3-4H2,1-2H3,(H2,10,11,12,13,14)
InChIKey QSELDKYOARDOCZ-UHFFFAOYSA-N
Mol Weight 198.22 g/mol
Molecular Formula C9H14N2O3
Exact Mass 198.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNz6MrVN05K
Name 5-(1-Methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
CAS Registry Number 83-29-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2O3
InChI InChI=1S/C9H14N2O3/c1-3-4-5(2)6-7(12)10-9(14)11-8(6)13/h5-6H,3-4H2,1-2H3,(H2,10,11,12,13,14)
InChIKey QSELDKYOARDOCZ-UHFFFAOYSA-N
Molecular Weight 198.222 g/mol
SMILES N1C(=O)NC(C(C(CCC)C)C1=O)=O
SPLASH splash10-004i-6900000000-24412e54f394aa56b1a7
Source of Spectrum CJ-1992-0-0
Synonyms 5-(1-Methylbutyl)barbituric acid 5-(1-Methylbutyl)hexahydropyrimidine-2,4,6-trione 5-Pentan-2-yl-1,3-diazinane-2,4,6-trione
Wiley ID 1195069