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2-OXO-4-(1,2,3,4-TETRAHYDRO-1,3,6-TRIMETHYL-2,4-DIOXOPYRIMIDIN-5-YL)-PENTANENITRILE
SpectraBase Compound ID 430ZW33zftv
InChI InChI=1S/C12H15N3O3/c1-7(5-9(16)6-13)10-8(2)14(3)12(18)15(4)11(10)17/h7H,5H2,1-4H3
InChIKey IWTZQHZDUZKKRR-UHFFFAOYSA-N
Mol Weight 249.27 g/mol
Molecular Formula C12H15N3O3
Exact Mass 249.111341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ekOnDv6R9O
Name 2-OXO-4-(1,2,3,4-TETRAHYDRO-1,3,6-TRIMETHYL-2,4-DIOXOPYRIMIDIN-5-YL)-PENTANENITRILE
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15N3O3
InChI InChI=1S/C12H15N3O3/c1-7(5-9(16)6-13)10-8(2)14(3)12(18)15(4)11(10)17/h7H,5H2,1-4H3
InChIKey IWTZQHZDUZKKRR-UHFFFAOYSA-N
Literature Reference Author J.C.ZHUO,H.WYLER
Literature Reference Citation HELV.CHIM.ACTA,76,1916(1993)
Literature Reference DOI 10.1002/hlca.19930760510
Molecular Weight 249.269 g/mol
Solvent CDCl3
Source File Reference UWRK1595