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3-(4-CHLORO-2-METHOXY-7H-PYRROLO-[2,3-D]-PYRIMIDIN-7-YL)-PROPANOIC-ACID
SpectraBase Compound ID LlxLUe5dMBy
InChI InChI=1S/C11H12ClN3O3/c1-17-8(16)4-6-15-5-3-7-9(12)13-11(18-2)14-10(7)15/h3,5H,4,6H2,1-2H3
InChIKey SABGAQQZQSJMIX-UHFFFAOYSA-N
Mol Weight 269.69 g/mol
Molecular Formula C11H12ClN3O3
Exact Mass 269.056719 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 30MhH8riT8I
Name 3-(4-CHLORO-2-METHOXY-7H-PYRROLO-[2,3-D]-PYRIMIDIN-7-YL)-PROPANOIC-ACID
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12ClN3O3
InChI InChI=1S/C11H12ClN3O3/c1-17-8(16)4-6-15-5-3-7-9(12)13-11(18-2)14-10(7)15/h3,5H,4,6H2,1-2H3
InChIKey SABGAQQZQSJMIX-UHFFFAOYSA-N
Literature Reference Author H.ROSEMEYER
Literature Reference Citation MOLBANK,M590(2009)
Molecular Weight 269.688 g/mol
Solvent DMSO-D6
Source File Reference UWLU83058