For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-NITRO-2,2,5-TRIMETHYL-m-DIOXANE
SpectraBase Compound ID 3HRVLkUWOGx
InChI InChI=1S/C7H13NO4/c1-6(2)11-4-7(3,5-12-6)8(9)10/h4-5H2,1-3H3
InChIKey NDRKIYYXYJRZQA-UHFFFAOYSA-N
Mol Weight 175.18 g/mol
Molecular Formula C7H13NO4
Exact Mass 175.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LDMHPPXhgZ1
Name 2,2,5-Trimethyl-5-nitro-1,3-dioxane
CAS Registry Number 4064-93-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H13NO4
InChI InChI=1S/C7H13NO4/c1-6(2)11-4-7(3,5-12-6)8(9)10/h4-5H2,1-3H3
InChIKey NDRKIYYXYJRZQA-UHFFFAOYSA-N
Literature Reference E.G. Janzen, R.L. Dudley, R.V.Shetty, J. Am. Chem. Soc. 101, 243 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3