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D,L-1,3-dioxo-α-[2-(methylthio)ethyl]-2-isoindolineacetic acid
SpectraBase Compound ID 1QfJnhLMWSK
InChI InChI=1S/C13H13NO4S/c1-19-7-6-10(13(17)18)14-11(15)8-4-2-3-5-9(8)12(14)16/h2-5,10H,6-7H2,1H3,(H,17,18)
InChIKey VMTKJVHNTIEOCU-UHFFFAOYSA-N
Mol Weight 279.31 g/mol
Molecular Formula C13H13NO4S
Exact Mass 279.056529 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7lKCfwWQo9I
Name D,L-1,3-dioxo-α-[2-(methylthio)ethyl]-2-isoindolineacetic acid
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO4S
InChI InChI=1S/C13H13NO4S/c1-19-7-6-10(13(17)18)14-11(15)8-4-2-3-5-9(8)12(14)16/h2-5,10H,6-7H2,1H3,(H,17,18)
InChIKey VMTKJVHNTIEOCU-UHFFFAOYSA-N
Instrument Name Varian A-60D
Sadtler NMR Number 20131M
Solvent CDCl3