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4-Nitro-benzoate anion

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4-Nitro-benzoate anion
SpectraBase Compound ID BozAVecSY6o
InChI InChI=1S/C7H5NO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4H,(H,9,10)/p-1
InChIKey OTLNPYWUJOZPPA-UHFFFAOYSA-M
Mol Weight 166.11 g/mol
Molecular Formula C7H4NO4
Exact Mass 166.014033 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J7DgAnk4OU3
Name 4-Nitro-benzoate anion
CAS Registry Number 2906-29-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H4NO4
InChI InChI=1S/C7H5NO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4H,(H,9,10)/p-1
InChIKey OTLNPYWUJOZPPA-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Literature Reference R.I. Gelb, L.M. Schwartz, B. Cardelino, J. Am. Chem. Soc. 103, 1750 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O