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1,3-Dinitro-1,3-diaza-cycloheptane
SpectraBase Compound ID 6o79Y9o5Ufx
InChI InChI=1S/C5H10N4O4/c10-8(11)6-3-1-2-4-7(5-6)9(12)13/h1-5H2
InChIKey XFBIFYVTPFYRSQ-UHFFFAOYSA-N
Mol Weight 190.16 g/mol
Molecular Formula C5H10N4O4
Exact Mass 190.070205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8MlhVUaNYUo
Name 1,3-Dinitro-1,3-diaza-cycloheptane
CAS Registry Number 5754-90-5
Comments NICOLET NT-200 WB SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H10N4O4
InChI InChI=1S/C5H10N4O4/c10-8(11)6-3-1-2-4-7(5-6)9(12)13/h1-5H2
InChIKey XFBIFYVTPFYRSQ-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference R.L. Willer, D.W. Moore, Magn. Res. Chem. 26, 95 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6