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5-Ethyl-5-(3-hydroxy-1-methylbutyl)-barbituric acid
SpectraBase Compound ID CFN2scLKjZB
InChI InChI=1S/C11H18N2O4/c1-4-11(6(2)5-7(3)14)8(15)12-10(17)13-9(11)16/h6-7,14H,4-5H2,1-3H3,(H2,12,13,15,16,17)
InChIKey XYOPMDJVSWQZTM-UHFFFAOYSA-N
Mol Weight 242.28 g/mol
Molecular Formula C11H18N2O4
Exact Mass 242.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QJCYS9bFYr
Name 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(3-hydroxy-1-methylbutyl)-
Alternate Name(s) 5-Ethyl-5-(3-hydroxy-1-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione 3'-Hydroxypentobarbital 3'-Hydroxypentobarbitone 5-Ethyl-5-(3-hydroxy-1-methyl-butyl)barbituric acid 5-Ethyl-5-(3-hydroxy-1-methyl-butyl)hexahydropyrimidine-2,4,6-trione 5-Ethyl-5-(4-hydroxypentan-2-yl)-1,3-diazinane-2,4,6-trione 5-Ethyl-5-(4-oxidanylpentan-2-yl)-1,3-diazinane-2,4,6-trione Barbituric acid, 5-ethyl-5-(3-hydroxy-1-methylbutyl)- Hydroxypentobarbital Hydroxypentobarbitone AI3-61884
CAS Registry Number 4241-40-1
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Formula C11H18N2O4
InChI InChI=1S/C11H18N2O4/c1-4-11(6(2)5-7(3)14)8(15)12-10(17)13-9(11)16/h6-7,14H,4-5H2,1-3H3,(H2,12,13,15,16,17)
InChIKey XYOPMDJVSWQZTM-UHFFFAOYSA-N
Molecular Weight 242.275 g/mol
SMILES N1C(NC(C(C(CC(O)C)C)(C1=O)CC)=O)=O
SPLASH splash10-0a4m-6900000000-9927bafa7b462d599300
Source of Spectrum MI-0-11-0
Wiley ID 1244720