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1,3-bis(1-methyl-4-nitropyrrol-2-yl)urea

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

1,3-bis(1-methyl-4-nitropyrrol-2-yl)urea
SpectraBase Compound ID JYZmD463KVG
InChI InChI=1S/C11H12N6O5/c1-14-5-7(16(19)20)3-9(14)12-11(18)13-10-4-8(17(21)22)6-15(10)2/h3-6H,1-2H3,(H2,12,13,18)
InChIKey QUAOGNPBYHEEAG-UHFFFAOYSA-N
Mol Weight 308.25 g/mol
Molecular Formula C11H12N6O5
Exact Mass 308.086918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID PXTSJPiQFd
Name 1,3-Bis(1-methyl-4-nitro-2-pyrrolyl)-urea
CAS Registry Number 78052-70-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12N6O5
InChI InChI=1S/C11H12N6O5/c1-14-5-7(16(19)20)3-9(14)12-11(18)13-10-4-8(17(21)22)6-15(10)2/h3-6H,1-2H3,(H2,12,13,18)
InChIKey QUAOGNPBYHEEAG-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference L. Grehn, Chemica Scripta 16, 85 (1980).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6