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3-[3-(4-METHYLPHENYLSUFONAMIDO)-PENTYL]-THIOPHENE-2-CARBOXYIC-ACID

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3-[3-(4-METHYLPHENYLSUFONAMIDO)-PENTYL]-THIOPHENE-2-CARBOXYIC-ACID
SpectraBase Compound ID HaztN3cungE
InChI InChI=1S/C17H21NO5S2/c1-3-13(6-9-16-15(17(19)20)10-11-24-16)18-23-25(21,22)14-7-4-12(2)5-8-14/h4-5,7-8,10-11,13,18H,3,6,9H2,1-2H3,(H,19,20)
InChIKey LPIXEJJMKTZNTB-UHFFFAOYSA-N
Mol Weight 383.48 g/mol
Molecular Formula C17H21NO5S2
Exact Mass 383.086115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WFsyYhC8yS
Name 3-[3-(4-METHYLPHENYLSUFONAMIDO)-PENTYL]-THIOPHENE-2-CARBOXYIC-ACID
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21NO5S2
InChI InChI=1S/C17H21NO5S2/c1-3-13(6-9-16-15(17(19)20)10-11-24-16)18-23-25(21,22)14-7-4-12(2)5-8-14/h4-5,7-8,10-11,13,18H,3,6,9H2,1-2H3,(H,19,20)
InChIKey LPIXEJJMKTZNTB-UHFFFAOYSA-N
Literature Reference Author A.M.COSTERO,S.GIL,M.PARRA,P.RODRIGUEZ
Literature Reference Citation MOLECULES,15,9135(2010)
Literature Reference DOI 10.3390/molecules15129135
Molecular Weight 383.477 g/mol
Sample ID 72768
Solvent CDCl3