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2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-1-methyl-3-[1-(methyl-D3)ethyl-1,2,2,2-D4]-
SpectraBase Compound ID GDJrRQgCV9C
InChI InChI=1S/C12H20N2O3/c1-6-12(7-2)9(15)13(5)11(17)14(8(3)4)10(12)16/h8H,6-7H2,1-5H3/i3D3,4D3,8D
InChIKey IFUAQHCBINEKDR-BGBULBDISA-N
Mol Weight 247.35 g/mol
Molecular Formula C12H132D7N2O3
Exact Mass 247.19133 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Tl3JUx8U8T
Name 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-1-methyl-3-[1-(methyl-D3)ethyl-1,2,2,2-D4]-
CAS Registry Number 132660-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13D7N2O3
InChI InChI=1S/C12H20N2O3/c1-6-12(7-2)9(15)13(5)11(17)14(8(3)4)10(12)16/h8H,6-7H2,1-5H3/i3D3,4D3,8D
InChIKey IFUAQHCBINEKDR-BGBULBDISA-N
Molecular Weight 247.346 g/mol
SMILES C1(N(C(=O)C(C(N1C)=O)(CC)CC)C(C([2D])([2D])[2D])(C([2D])([2D])[2D])[2D])=O
SPLASH splash10-0600-9640000000-6ecacc8f8b0ea8231040
Source of Spectrum H-73-2285-10
Synonyms 5,5-Diethyl-1-(heptadeuterio)isopropyl-3-methylbarbituric acid
Wiley ID 1242753