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3-(4-Aminomethyl-benzyl)-1,5,9-triaza-cyclododecane

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3-(4-Aminomethyl-benzyl)-1,5,9-triaza-cyclododecane
SpectraBase Compound ID BE2irZ1PT28
InChI InChI=1S/C17H30N4/c18-12-16-5-3-15(4-6-16)11-17-13-20-9-1-7-19-8-2-10-21-14-17/h3-6,17,19-21H,1-2,7-14,18H2
InChIKey LQPXIAWWCAUXPX-UHFFFAOYSA-N
Mol Weight 290.45 g/mol
Molecular Formula C17H30N4
Exact Mass 290.247047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6hYLN8Gse6O
Name 3-(4-Aminomethyl-benzyl)-1,5,9-triaza-cyclododecane
CAS Registry Number 127603-42-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H30N4
InChI InChI=1S/C17H30N4/c18-12-16-5-3-15(4-6-16)11-17-13-20-9-1-7-19-8-2-10-21-14-17/h3-6,17,19-21H,1-2,7-14,18H2
InChIKey LQPXIAWWCAUXPX-UHFFFAOYSA-N
Instrument Name Bruker AC-250
Literature Reference I.M. Helps, D. Parker, K.J. Jankowski, J. Chem. Soc. Perkin I 2079 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O