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1,1'-dimethyl-2',3-dinitro-2,3'-bipyrrole-5,5'-dicarboxylic acid, diethyl ester

View entire compound with spectra: 3 NMR, and 1 FTIR

1,1'-dimethyl-2',3-dinitro-2,3'-bipyrrole-5,5'-dicarboxylic acid, diethyl ester
SpectraBase Compound ID 29Pj4KwFjZ8
InChI InChI=1S/C16H18N4O8/c1-5-27-15(21)11-7-9(14(18(11)4)20(25)26)13-10(19(23)24)8-12(17(13)3)16(22)28-6-2/h7-8H,5-6H2,1-4H3
InChIKey NFEVKVDRWGVAQP-UHFFFAOYSA-N
Mol Weight 394.34 g/mol
Molecular Formula C16H18N4O8
Exact Mass 394.112464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JjlHB6enwrJ
Name 1,1'-Dimethyl-2,3'-dinitro-3,2'-bipyrrole-5,5'-dicarboxylic acid, diethyl ester
CAS Registry Number 72795-86-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H18N4O8
InChI InChI=1S/C16H18N4O8/c1-5-27-15(21)11-7-9(14(18(11)4)20(25)26)13-10(19(23)24)8-12(17(13)3)16(22)28-6-2/h7-8H,5-6H2,1-4H3
InChIKey NFEVKVDRWGVAQP-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