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3-(Acetamidomethylbenzyl)-1,5,9-triaza-cyclododecane

View entire compound with spectra: 1 NMR

3-(Acetamidomethylbenzyl)-1,5,9-triaza-cyclododecane
SpectraBase Compound ID Igxs9kQp9K7
InChI InChI=1S/C19H32N4O/c1-16(24)23-15-18-6-4-17(5-7-18)12-19-13-21-10-2-8-20-9-3-11-22-14-19/h4-7,19-22H,2-3,8-15H2,1H3,(H,23,24)
InChIKey PSSHHAUUGXCJIZ-UHFFFAOYSA-N
Mol Weight 332.5 g/mol
Molecular Formula C19H32N4O
Exact Mass 332.257612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JThADKiH0zI
Name 3-(Acetamidomethylbenzyl)-1,5,9-triaza-cyclododecane
CAS Registry Number 124659-33-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H32N4O
InChI InChI=1S/C19H32N4O/c1-16(24)23-15-18-6-4-17(5-7-18)12-19-13-21-10-2-8-20-9-3-11-22-14-19/h4-7,19-22H,2-3,8-15H2,1H3,(H,23,24)
InChIKey PSSHHAUUGXCJIZ-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 CDCl3