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alpha-(butylamino)-alpha-(trichloromethyl)-p-tolualdehyde, hydrochloride
SpectraBase Compound ID GJlmGVVEmQn
InChI InChI=1S/C13H16Cl3NO.ClH/c1-2-3-8-17-12(13(14,15)16)11-6-4-10(9-18)5-7-11;/h4-7,9,12,17H,2-3,8H2,1H3;1H
InChIKey NNDKKGMERRGCKC-UHFFFAOYSA-N
Mol Weight 345.1 g/mol
Molecular Formula C13H17Cl4NO
Exact Mass 343.006425 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IiXWGyTUuoN
Name alpha-(butylamino)-alpha-(trichloromethyl)-p-tolualdehyde, hydrochloride
Source of Sample A. LUKASIEWICZ, INSTITUTE OF NUCLEAR RESEARCH, WARSAW, POLAND
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Formula C13H17Cl4NO
InChI InChI=1S/C13H16Cl3NO.ClH/c1-2-3-8-17-12(13(14,15)16)11-6-4-10(9-18)5-7-11;/h4-7,9,12,17H,2-3,8H2,1H3;1H
InChIKey NNDKKGMERRGCKC-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 1387M
Solvent TFA
Synonyms BENZALDEHYDE, P-/1-/BUTYLAMINO/- 2,2,2-TRICHLOROETHYL/-, HYDROCHLORIDE