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N-(3,6,9,12-Tetraoxa-tridec-1-yl)-monoaza-16-crown-6

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(3,6,9,12-Tetraoxa-tridec-1-yl)-monoaza-16-crown-6
SpectraBase Compound ID 8l5eCEypUeb
InChI InChI=1S/C21H43NO9/c1-23-8-9-27-16-17-28-13-10-24-5-2-22-3-6-25-11-14-29-18-20-31-21-19-30-15-12-26-7-4-22/h2-21H2,1H3
InChIKey JYDBJWPQJWFCRM-UHFFFAOYSA-N
Mol Weight 453.6 g/mol
Molecular Formula C21H43NO9
Exact Mass 453.293782 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jfBDX7orLV
Name N-(3,6,9,12-Tetraoxa-tridec-1-yl)-monoaza-16-crown-6
CAS Registry Number 80755-65-3
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H43NO9
InChI InChI=1S/C21H43NO9/c1-23-8-9-27-16-17-28-13-10-24-5-2-22-3-6-25-11-14-29-18-20-31-21-19-30-15-12-26-7-4-22/h2-21H2,1H3
InChIKey JYDBJWPQJWFCRM-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference R.A. Schultz, B.D. White, D.M. Dishong, J. Am. Chem. Soc. 107, 6659 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3