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3-[(p-chlorophenyl)carbamoyl]-1-[(dodecylcarbamoyl)methyl]pyridinium chloride
SpectraBase Compound ID 4Op5CcGvczi
InChI InChI=1S/C26H36ClN3O2.ClH/c1-2-3-4-5-6-7-8-9-10-11-18-28-25(31)21-30-19-12-13-22(20-30)26(32)29-24-16-14-23(27)15-17-24;/h12-17,19-20H,2-11,18,21H2,1H3,(H-,28,29,31,32);1H
InChIKey RGWILTWJTKXYBU-UHFFFAOYSA-N
Mol Weight 494.5 g/mol
Molecular Formula C26H37Cl2N3O2
Exact Mass 493.226283 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EbpLQ4gbcFP
Name 3-[(p-chlorophenyl)carbamoyl]-1-[(dodecylcarbamoyl)methyl]pyridinium chloride
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Formula C26H37Cl2N3O2
InChI InChI=1S/C26H36ClN3O2.ClH/c1-2-3-4-5-6-7-8-9-10-11-18-28-25(31)21-30-19-12-13-22(20-30)26(32)29-24-16-14-23(27)15-17-24;/h12-17,19-20H,2-11,18,21H2,1H3,(H-,28,29,31,32);1H
InChIKey RGWILTWJTKXYBU-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 33688M
Solvent Polysol