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5-(4-Methyl-2-nitrophenyl)-2-furoic acid

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

5-(4-Methyl-2-nitrophenyl)-2-furoic acid
SpectraBase Compound ID 3blTGz1b2iI
InChI InChI=1S/C12H9NO5/c1-7-2-3-8(9(6-7)13(16)17)10-4-5-11(18-10)12(14)15/h2-6H,1H3,(H,14,15)
InChIKey UNSSRIPGQQOYLI-UHFFFAOYSA-N
Mol Weight 247.21 g/mol
Molecular Formula C12H9NO5
Exact Mass 247.048072 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7vjsN4qPyAx
Name 5-(4-Methyl-2-nitrophenyl)-2-furoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 447838
CAS Registry Number 55377-91-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9NO5
InChI InChI=1S/C12H9NO5/c1-7-2-3-8(9(6-7)13(16)17)10-4-5-11(18-10)12(14)15/h2-6H,1H3,(H,14,15)
InChIKey UNSSRIPGQQOYLI-UHFFFAOYSA-N
Observed nucleus 13C
Purity 95%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 5-(4-Methyl-2-nitrophenyl)-2-furancarboxylic acid
Wiley ID SIAL_13CNMR_009873