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HOM;3-(2-HYDROXY-5-NITRO-BENZYL-THIO)-PROPIONIC-ACID
SpectraBase Compound ID Gq7VFEIQJG
InChI InChI=1S/C10H11NO5S/c12-9-2-1-8(11(15)16)5-7(9)6-17-4-3-10(13)14/h1-2,5,12H,3-4,6H2,(H,13,14)
InChIKey VTPSNOWCFWROKL-UHFFFAOYSA-N
Mol Weight 257.26 g/mol
Molecular Formula C10H11NO5S
Exact Mass 257.035794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ch9dNd6iMpw
Name HOM;3-(2-HYDROXY-5-NITRO-BENZYL-THIO)-PROPIONIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H11NO5S
InChI InChI=1S/C10H11NO5S/c12-9-2-1-8(11(15)16)5-7(9)6-17-4-3-10(13)14/h1-2,5,12H,3-4,6H2,(H,13,14)
InChIKey VTPSNOWCFWROKL-UHFFFAOYSA-N
Literature Reference Author A.QUBINA,B.BALLESTEROS,R.GALVE,D.BARCELO,M.P.MARCO
Literature Reference Citation ANAL.CHIM.ACTA,387,255(1999)
Literature Reference DOI 10.1016/s0003-2670(98)00775-2
Molecular Weight 257.261 g/mol
Solvent DMSO-D6
Source File Reference UWBT11223