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N,N'-Bis(cyanomethyl)-N,N'-dioctyl-methanediamine
SpectraBase Compound ID 1ucFsfn4COQ
InChI InChI=1S/C21H40N4/c1-3-5-7-9-11-13-17-24(19-15-22)21-25(20-16-23)18-14-12-10-8-6-4-2/h3-14,17-21H2,1-2H3
InChIKey KPWULMCMLUHWLU-UHFFFAOYSA-N
Mol Weight 348.6 g/mol
Molecular Formula C21H40N4
Exact Mass 348.325297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ATN2sqGgSkF
Name N,N'-Bis(cyanomethyl)-N,N'-dioctyl-methanediamine
CAS Registry Number 129410-48-6
Comments SHIFTCORRECTION: +0.2 PPM, REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H40N4
InChI InChI=1S/C21H40N4/c1-3-5-7-9-11-13-17-24(19-15-22)21-25(20-16-23)18-14-12-10-8-6-4-2/h3-14,17-21H2,1-2H3
InChIKey KPWULMCMLUHWLU-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference A.R. Katritzky, B. Pilarski, L. Urogdi, J. Chem. Soc. Perkin I 541 (1990).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3