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4-HYDROXY-5-NITROMETANILIC ACID
SpectraBase Compound ID HSOJZwvDrww
InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
InChIKey RHPXYZMDLOJTFF-UHFFFAOYSA-N
Mol Weight 234.18 g/mol
Molecular Formula C6H6N2O6S
Exact Mass 233.994657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID rHogMpPNQe
Name 4-HYDROXY-5-NITROMETANILIC ACID
Source of Sample R. Rupprecht, W. Bremser BASF Ludwigshafen (1983)
CAS Registry Number 96-93-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6N2O6S
InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
InChIKey RHPXYZMDLOJTFF-UHFFFAOYSA-N
Molecular Weight 234.19
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-360
Synonyms METANILIC ACID, 4-HYDROXY-5-NITRO-,