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1,2-dimethyl-3,5-dinitropyrrole

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1,2-dimethyl-3,5-dinitropyrrole
SpectraBase Compound ID 5DNev13tMFU
InChI InChI=1S/C6H7N3O4/c1-4-5(8(10)11)3-6(7(4)2)9(12)13/h3H,1-2H3
InChIKey CUHUQZDGFIIIBZ-UHFFFAOYSA-N
Mol Weight 185.14 g/mol
Molecular Formula C6H7N3O4
Exact Mass 185.043656 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CZHjp5ZN01j
Name 1H-Pyrrole, 1,2-dimethyl-3,5-dinitro-
CAS Registry Number 72795-83-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H7N3O4
InChI InChI=1S/C6H7N3O4/c1-4-5(8(10)11)3-6(7(4)2)9(12)13/h3H,1-2H3
InChIKey CUHUQZDGFIIIBZ-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference L. Grehn, Chemica Scripta 13, 67 (1978).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6