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2-Nitro-m-toluic acid

View entire compound with spectra: 5 NMR, 2 FTIR, and 1 MS (GC)

2-Nitro-m-toluic acid
SpectraBase Compound ID gTugBWlBFJ
InChI InChI=1S/C8H7NO4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3,(H,10,11)
InChIKey DGDAVTPQCQXLGU-UHFFFAOYSA-N
Mol Weight 181.15 g/mol
Molecular Formula C8H7NO4
Exact Mass 181.037508 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID He7roxnUtLO
Name 2-nitro-m-toluic acid
Source of Sample J. Shackelford, Melpar Inc., Falls Church, Virginia
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO4
InChI InChI=1S/C8H7NO4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3,(H,10,11)
InChIKey DGDAVTPQCQXLGU-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference JOCE 26, 4908(1961)
Sadtler NMR Number 7832M
Solvent Acetone-d6
Synonyms BENZOIC ACID, 3-METHYL-2-NITRO-, M-TOLUIC ACID, 2-NITRO-,