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5-ACETYLAMINO-1-METHYL-4-NITROPYRROL-2-CARBONSAEURE-ETHYLESTER

View entire compound with spectra: 2 NMR, and 1 FTIR

5-ACETYLAMINO-1-METHYL-4-NITROPYRROL-2-CARBONSAEURE-ETHYLESTER
SpectraBase Compound ID LJ4pzEWyU8w
InChI InChI=1S/C10H13N3O5/c1-4-18-10(15)8-5-7(13(16)17)9(12(8)3)11-6(2)14/h5H,4H2,1-3H3,(H,11,14)
InChIKey MBWQXQRHWHENGE-UHFFFAOYSA-N
Mol Weight 255.23 g/mol
Molecular Formula C10H13N3O5
Exact Mass 255.085521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IUN7SC4SPJM
Name 5-Acetylamino-1-methyl-4-nitro-pyrrole-2-carboxylic acid, ethyl ester
CAS Registry Number 78080-79-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H13N3O5
InChI InChI=1S/C10H13N3O5/c1-4-18-10(15)8-5-7(13(16)17)9(12(8)3)11-6(2)14/h5H,4H2,1-3H3,(H,11,14)
InChIKey MBWQXQRHWHENGE-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