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1-(5-Carboxy-pentyl)-2,4,6-trimethyl-pyridinium cation
SpectraBase Compound ID WAC8TM20gV
InChI InChI=1S/C14H21NO2/c1-11-9-12(2)15(13(3)10-11)8-6-4-5-7-14(16)17/h9-10H,4-8H2,1-3H3/p+1
InChIKey WBBJRDGSCSLDCS-UHFFFAOYSA-O
Mol Weight 236.33 g/mol
Molecular Formula C14H22NO2
Exact Mass 236.165054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6YzoJVhH2kd
Name 1-(5-Carboxy-pentyl)-2,4,6-trimethyl-pyridinium cation
CAS Registry Number 79783-18-9
Comments perchlorate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H22NO2
InChI InChI=1S/C14H21NO2/c1-11-9-12(2)15(13(3)10-11)8-6-4-5-7-14(16)17/h9-10H,4-8H2,1-3H3/p+1
InChIKey WBBJRDGSCSLDCS-UHFFFAOYSA-O
Instrument Name Varian FT-80
Literature Reference A.T. Balaban, A. Dinculescu, J. Elguero, Magn. Res. Chem. 23, 553 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6