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2-(3-cyanopropylsulfamoyl)benzoic acid

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2-(3-cyanopropylsulfamoyl)benzoic acid
SpectraBase Compound ID LLQtfawdCJV
InChI InChI=1S/C11H12N2O4S/c12-7-3-4-8-13-18(16,17)10-6-2-1-5-9(10)11(14)15/h1-2,5-6,13H,3-4,8H2,(H,14,15)
InChIKey PIUVZGIWTMFESO-UHFFFAOYSA-N
Mol Weight 268.29 g/mol
Molecular Formula C11H12N2O4S
Exact Mass 268.051778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HeC12Rr0Bp8
Name 2-(3-cyanopropylsulfamoyl)benzoic acid
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12N2O4S
InChI InChI=1S/C11H12N2O4S/c12-7-3-4-8-13-18(16,17)10-6-2-1-5-9(10)11(14)15/h1-2,5-6,13H,3-4,8H2,(H,14,15)
InChIKey PIUVZGIWTMFESO-UHFFFAOYSA-N
Literature Reference Author M.BLANCO,I.A.PERILLO,C.B.SCHAPIRA
Literature Reference Citation J.HETCYCL.CHEM.,32,145(1995)
Literature Reference DOI 10.1002/jhet.5570320124
Molecular Weight 268.287 g/mol
Solvent CDCl3
Source File Reference UWCS20716