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4-(ETHOXYCARBONYL)-2-OXO-4-(1,2,3,4-TETRAHYDRO-1,3,6-TRIMETHYL-2,4-DIOXOPYRIMIDIN-5-YL)-BUTANENITRILE
SpectraBase Compound ID 2MFXCBuPHN2
InChI InChI=1S/C14H17N3O5/c1-5-22-13(20)10(6-9(18)7-15)11-8(2)16(3)14(21)17(4)12(11)19/h10H,5-6H2,1-4H3
InChIKey VCGCWTSAMPQSIU-UHFFFAOYSA-N
Mol Weight 307.31 g/mol
Molecular Formula C14H17N3O5
Exact Mass 307.116821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JrzOYRqjBYX
Name 4-(ETHOXYCARBONYL)-2-OXO-4-(1,2,3,4-TETRAHYDRO-1,3,6-TRIMETHYL-2,4-DIOXOPYRIMIDIN-5-YL)-BUTANENITRILE
Compound Number 13C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17N3O5
InChI InChI=1S/C14H17N3O5/c1-5-22-13(20)10(6-9(18)7-15)11-8(2)16(3)14(21)17(4)12(11)19/h10H,5-6H2,1-4H3
InChIKey VCGCWTSAMPQSIU-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 307.306 g/mol
Solvent CDCl3
Source File Reference UWRK1596