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C5H5N(CH2)3COO;1-(OMEGA-CARBOXYPROPYL)-PYRIDINIUM
SpectraBase Compound ID GXwAvAfKty4
InChI InChI=1S/C9H11NO2/c11-9(12)5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8H2
InChIKey CEXFEPJWNWJBDN-UHFFFAOYSA-N
Mol Weight 165.19 g/mol
Molecular Formula C9H11NO2
Exact Mass 165.078979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Hke6rgibyH
Name C5H5N(CH2)3COO;1-(OMEGA-CARBOXYPROPYL)-PYRIDINIUM
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11NO2
InChI InChI=1S/C9H11NO2/c11-9(12)5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8H2
InChIKey CEXFEPJWNWJBDN-UHFFFAOYSA-N
Literature Reference Author M.SZAFRAN,Z.DEGA-SZAFRAN,A.KATRUSIAK,G.BUCZAK,T.GLOWIAK,J.SI TKOWSKI,L.STEFANIAK
Literature Reference Citation J.ORG.CHEM.,63,2898(1998)
Literature Reference DOI 10.1021/jo9720694
Molecular Weight 165.192 g/mol
Sample ID 37118
Solvent D2O