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N-([2-Nitro-phenyl]-sulfenyl)-L-threonine

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N-([2-Nitro-phenyl]-sulfenyl)-L-threonine
SpectraBase Compound ID yknT0WBB4Y
InChI InChI=1S/C10H12N2O5S/c1-6(13)9(10(14)15)11-18-8-5-3-2-4-7(8)12(16)17/h2-6,9,11,13H,1H3,(H,14,15)
InChIKey QJMPRIHAPGGFMA-UHFFFAOYSA-N
Mol Weight 272.27 g/mol
Molecular Formula C10H12N2O5S
Exact Mass 272.046693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ZDIkhSHcQW
Name N-([2-Nitro-phenyl]-sulfenyl)-L-threonine
CAS Registry Number 7685-70-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H12N2O5S
InChI InChI=1S/C10H12N2O5S/c1-6(13)9(10(14)15)11-18-8-5-3-2-4-7(8)12(16)17/h2-6,9,11,13H,1H3,(H,14,15)
InChIKey QJMPRIHAPGGFMA-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference E.M. Gordon, M.A. Ondetti, J. Pluscec, J. Am. Chem. Soc. 104, 6053 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6