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ISOBUTYL-2-CYANO-2-(PERHYDRO-4-OXOPYRIMIDIN-2-YLIDENE)-ACETATE
SpectraBase Compound ID L483kYCrPmf
InChI InChI=1S/C11H15N3O3/c1-7(2)6-17-11(16)8(5-12)10-13-4-3-9(15)14-10/h7,13H,3-4,6H2,1-2H3,(H,14,15)/b10-8+
InChIKey YGUXLPKLBISRAI-CSKARUKUSA-N
Mol Weight 237.26 g/mol
Molecular Formula C11H15N3O3
Exact Mass 237.111341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3aPSestpR3
Name ISOBUTYL-2-CYANO-2-(PERHYDRO-4-OXOPYRIMIDIN-2-YLIDENE)-ACETATE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H15N3O3
InChI InChI=1S/C11H15N3O3/c1-7(2)6-17-11(16)8(5-12)10-13-4-3-9(15)14-10/h7,13H,3-4,6H2,1-2H3,(H,14,15)/b10-8+
InChIKey YGUXLPKLBISRAI-CSKARUKUSA-N
Literature Reference Author R.NEIDLEIN,Z.SUI
Literature Reference Citation HELV.CHIM.ACTA,74,579(1991)
Literature Reference DOI 10.1002/hlca.19910740315
Molecular Weight 237.258 g/mol
Solvent DMSO-D6
Source File Reference UWVP5642