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N-BUTYL-alpha-(TRICHLOROMETHYL)-2-NAPHTHALENEMETHYLAMINE, NITRATE
SpectraBase Compound ID CJofsvioFjU
InChI InChI=1S/C16H18Cl3N.NO3/c1-2-3-10-20-15(16(17,18)19)14-9-8-12-6-4-5-7-13(12)11-14;2-1(3)4/h4-9,11,15,20H,2-3,10H2,1H3;/q;-1/p+1
InChIKey MBQUQCIRALWGMD-UHFFFAOYSA-O
Mol Weight 393.7 g/mol
Molecular Formula C16H19Cl3N2O3
Exact Mass 392.046126 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F69S1hRmP4i
Name N-BUTYL-alpha-(TRICHLOROMETHYL)-2-NAPHTHALENEMETHYLAMINE, NITRATE
Source of Sample A. Lukasiewicz, Institute of Nuclear Research, Warsaw, Poland
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18Cl3N HNO3
InChI InChI=1S/C16H18Cl3N.NO3/c1-2-3-10-20-15(16(17,18)19)14-9-8-12-6-4-5-7-13(12)11-14;2-1(3)4/h4-9,11,15,20H,2-3,10H2,1H3;/q;-1/p+1
InChIKey MBQUQCIRALWGMD-UHFFFAOYSA-O
Melting Point 156-157.5C (dec.)
Molecular Weight 393.73
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2-NAPHTHALENEMETHYLAMINE, N-BUTYL-A-/TRICHLOROMETHYL/-, NITRATE