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2-([2-Nitro-phenoxy]-methyl)-18-crown-6
SpectraBase Compound ID w0W8zKpsN1
InChI InChI=1S/C19H29NO9/c21-20(22)18-3-1-2-4-19(18)29-16-17-15-27-12-11-25-8-7-23-5-6-24-9-10-26-13-14-28-17/h1-4,17H,5-16H2
InChIKey MXBOHBICLDFGKY-UHFFFAOYSA-N
Mol Weight 415.44 g/mol
Molecular Formula C19H29NO9
Exact Mass 415.184232 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Aws4LmwnRYU
Name 2-([2-Nitro-phenoxy]-methyl)-18-crown-6
CAS Registry Number 94978-62-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H29NO9
InChI InChI=1S/C19H29NO9/c21-20(22)18-3-1-2-4-19(18)29-16-17-15-27-12-11-25-8-7-23-5-6-24-9-10-26-13-14-28-17/h1-4,17H,5-16H2
InChIKey MXBOHBICLDFGKY-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference A, Kaifer, D.A. Gutowski, L. Echegoyen, J. Am. Chem. Soc. 107, 1958 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CH3CN