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2-Cyanomethyl-1,4,8,11-tetraoxa-cyclotetradecane

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2-Cyanomethyl-1,4,8,11-tetraoxa-cyclotetradecane
SpectraBase Compound ID L1QQotSEApL
InChI InChI=1S/C12H21NO4/c13-4-3-12-11-16-7-1-5-14-9-10-15-6-2-8-17-12/h12H,1-3,5-11H2
InChIKey DFNWQQXICORHPV-UHFFFAOYSA-N
Mol Weight 243.3 g/mol
Molecular Formula C12H21NO4
Exact Mass 243.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KfxOTEqIoxg
Name 2-Cyanomethyl-1,4,8,11-tetraoxa-cyclotetradecane
CAS Registry Number 127376-08-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H21NO4
InChI InChI=1S/C12H21NO4/c13-4-3-12-11-16-7-1-5-14-9-10-15-6-2-8-17-12/h12H,1-3,5-11H2
InChIKey DFNWQQXICORHPV-UHFFFAOYSA-N
Instrument Name Bruker AC-250
Literature Reference R. Kataky, P.E. Nicholson, D. Parker, J. Chem. Soc. Perkin II 321 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3