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(5-fluoro-2-benzimidazolylthio)acetic acid
SpectraBase Compound ID 88QVNHGjVUb
InChI InChI=1S/C9H7FN2O2S/c10-5-1-2-6-7(3-5)12-9(11-6)15-4-8(13)14/h1-3H,4H2,(H,11,12)(H,13,14)
InChIKey SUBRQUMRYKKVPF-UHFFFAOYSA-N
Mol Weight 226.23 g/mol
Molecular Formula C9H7FN2O2S
Exact Mass 226.021227 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7AKXd2AS6oa
Name [(5-FLUORO-2-BENZIMIDAZOLYL)THIO]ACETIC ACID
Comments IT WAS MENTIONED IN ORIGINAL, THAT EXTERNAL STANDARD IS C6F6, BUT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7FN2O2S
InChI InChI=1S/C9H7FN2O2S/c10-5-1-2-6-7(3-5)12-9(11-6)15-4-8(13)14/h1-3H,4H2,(H,11,12)(H,13,14)
InChIKey SUBRQUMRYKKVPF-UHFFFAOYSA-N
Instrument Name JEOL GX-400
Literature Reference H.K.PUJARI, B.R.SHARMA, RAJENDER DAHIYA, SUDHIR KUMAR (1990) J.Fluor.Chem.:v.46, N2, 343-355.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo