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

*Links on SpectraBase are not permalinks.
(5(4)-Nitroimidazol-4(5)-yl)-methylnitrate
SpectraBase Compound ID CVLPcsAph4S
InChI InChI=1S/C4H4N4O5/c9-7(10)4-3(5-2-6-4)1-13-8(11)12/h2H,1H2,(H,5,6)
InChIKey ULZDUAFXATUPCS-UHFFFAOYSA-N
Mol Weight 188.1 g/mol
Molecular Formula C4H4N4O5
Exact Mass 188.018169 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 IiDVWApsAxV
Name (5(4)-Nitroimidazol-4(5)-yl)-methylnitrate
CAS Registry Number 81246-36-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H4N4O5
InChI InChI=1S/C4H4N4O5/c9-7(10)4-3(5-2-6-4)1-13-8(11)12/h2H,1H2,(H,5,6)
InChIKey ULZDUAFXATUPCS-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 47, 2661 (1982).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6