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[4-(5-carbethoxy-2-keto-6-methyl-3,4-dihydro-1H-pyrimidin-4-yl)phenyl]boronic acid
SpectraBase Compound ID CmnvP1XCE7N
InChI InChI=1S/C14H17BN2O5/c1-3-22-13(18)11-8(2)16-14(19)17-12(11)9-4-6-10(7-5-9)15(20)21/h4-7,12,20-21H,3H2,1-2H3,(H2,16,17,19)
InChIKey OZKJGCHXVJVWSZ-UHFFFAOYSA-N
Mol Weight 304.1 g/mol
Molecular Formula C14H17BN2O5
Exact Mass 304.123052 g/mol

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HkJopo6xl5U
Name [4-(5-carbethoxy-2-keto-6-methyl-3,4-dihydro-1H-pyrimidin-4-yl)phenyl]boronic acid
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17BN2O5
InChI InChI=1S/C14H17BN2O5/c1-3-22-13(18)11-8(2)16-14(19)17-12(11)9-4-6-10(7-5-9)15(20)21/h4-7,12,20-21H,3H2,1-2H3,(H2,16,17,19)
InChIKey OZKJGCHXVJVWSZ-UHFFFAOYSA-N
Literature Reference Author J.M.BLACQUIERE,O.SICORA,C.M.VOGELS,M.CUPERLOVIC-CULF,A.DECKE N,R.J.OUELLETTE,S.
Literature Reference Citation CAN.J.CHEM.,83,2052(2005)
Literature Reference DOI 10.1139/v05-211
Solvent THF
Source File Reference UWLU30329