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5-(2-CHLOROETHYL)-N-1-[(1,3-DIBENZYLOXY-2-PROPOXY)-METHYL]-PYRIMIDIN-2,4-DIONE

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5-(2-CHLOROETHYL)-N-1-[(1,3-DIBENZYLOXY-2-PROPOXY)-METHYL]-PYRIMIDIN-2,4-DIONE
SpectraBase Compound ID AFP0qehNb9Q
InChI InChI=1S/C24H27ClN2O5/c25-12-11-21-13-27(24(29)26-23(21)28)18-32-22(16-30-14-19-7-3-1-4-8-19)17-31-15-20-9-5-2-6-10-20/h1-10,13,22H,11-12,14-18H2,(H,26,28,29)
InChIKey WGALEALPGLPTGI-UHFFFAOYSA-N
Mol Weight 458.94 g/mol
Molecular Formula C24H27ClN2O5
Exact Mass 458.16085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ElO4a2193B
Name 5-(2-CHLOROETHYL)-N-1-[(1,3-DIBENZYLOXY-2-PROPOXY)-METHYL]-PYRIMIDIN-2,4-DIONE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H27ClN2O5
InChI InChI=1S/C24H27ClN2O5/c25-12-11-21-13-27(24(29)26-23(21)28)18-32-22(16-30-14-19-7-3-1-4-8-19)17-31-15-20-9-5-2-6-10-20/h1-10,13,22H,11-12,14-18H2,(H,26,28,29)
InChIKey WGALEALPGLPTGI-UHFFFAOYSA-N
Literature Reference Author A.MESCIC,S.KRISTAFOR,I.NOVAKOVIC,A.OSMANOVIC,U.MULLER,D.ZAVR SNIK,S.M.AMETAMEY
Literature Reference Citation MOLECULES,18,5104(2013)
Literature Reference DOI 10.3390/molecules18055104
Molecular Weight 458.942 g/mol
Solvent DMSO-D6
Source File Reference UWBT9202