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2-Methyl-4-nitro-1-imidazolepropionic acid

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

2-Methyl-4-nitro-1-imidazolepropionic acid
SpectraBase Compound ID KCWEeLWB42W
InChI InChI=1S/C7H9N3O4/c1-5-8-6(10(13)14)4-9(5)3-2-7(11)12/h4H,2-3H2,1H3,(H,11,12)
InChIKey QIJTUXYFQLHGJI-UHFFFAOYSA-N
Mol Weight 199.17 g/mol
Molecular Formula C7H9N3O4
Exact Mass 199.059306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 27dpEgr1zcS
Name 2-Methyl-4-nitro-1-imidazolepropionic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 380199
CAS Registry Number 16935-04-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N3O4
InChI InChI=1S/C7H9N3O4/c1-5-8-6(10(13)14)4-9(5)3-2-7(11)12/h4H,2-3H2,1H3,(H,11,12)
InChIKey QIJTUXYFQLHGJI-UHFFFAOYSA-N
Observed nucleus 1H
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_008171