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2-(2-nitrothiophen-3-yl)sulfanylacetic acid
SpectraBase Compound ID APvVr2aWMX4
InChI InChI=1S/C6H5NO4S2/c8-5(9)3-13-4-1-2-12-6(4)7(10)11/h1-2H,3H2,(H,8,9)
InChIKey MEEZSVKAWULOFH-UHFFFAOYSA-N
Mol Weight 219.23 g/mol
Molecular Formula C6H5NO4S2
Exact Mass 218.966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ApurAYKrFVA
Name 2-(2-Nitro-thienylthio)-acetic acid
CAS Registry Number 77151-59-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H5NO4S2
InChI InChI=1S/C6H5NO4S2/c8-5(9)3-13-4-1-2-12-6(4)7(10)11/h1-2H,3H2,(H,8,9)
InChIKey MEEZSVKAWULOFH-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference P. Granger, S. Chapelle, C. Paulmier, Org. Magn. Resonance 14, 240 (1980).
NMR Standard Acetone-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6