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Ethylthio-nitro-acetic acid, ethyl ester
SpectraBase Compound ID 3fR0d1Hd8Br
InChI InChI=1S/C6H11NO4S/c1-3-11-6(8)5(7(9)10)12-4-2/h5H,3-4H2,1-2H3
InChIKey HFKJFRHMBOXYRQ-UHFFFAOYSA-N
Mol Weight 193.22 g/mol
Molecular Formula C6H11NO4S
Exact Mass 193.040879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ODDkrPDUbQ
Name Ethylthio-nitro-acetic acid, ethyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H11NO4S
InChI InChI=1S/C6H11NO4S/c1-3-11-6(8)5(7(9)10)12-4-2/h5H,3-4H2,1-2H3
InChIKey HFKJFRHMBOXYRQ-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference Y. Takeuchi, N. Itoh, T. Koizumi, Magn. Res. Chem. 30, 58 (1992).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3