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2-ACETYL-1-(PHENYLSULFONYL)-3-INDOLEACETIC-ACID
SpectraBase Compound ID 5vBXiyEERXZ
InChI InChI=1S/C18H15NO5S/c1-12(20)18-15(11-17(21)22)14-9-5-6-10-16(14)19(18)25(23,24)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,21,22)
InChIKey FCDWMTZNIPCDCC-UHFFFAOYSA-N
Mol Weight 357.38 g/mol
Molecular Formula C18H15NO5S
Exact Mass 357.067094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BbBk55El5VK
Name 2-ACETYL-1-(PHENYLSULFONYL)-3-INDOLEACETIC-ACID
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H15NO5S
InChI InChI=1S/C18H15NO5S/c1-12(20)18-15(11-17(21)22)14-9-5-6-10-16(14)19(18)25(23,24)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,21,22)
InChIKey FCDWMTZNIPCDCC-UHFFFAOYSA-N
Literature Reference Author M.AMAT,F.SUBRIZI,V.ELIAS,N.LLOR,E.MOLINS,J.BOSCH
Literature Reference Citation EUR.J.ORG.CHEM.,2012,1835(2012)
Literature Reference DOI 10.1002/ejoc.201101718
Molecular Weight 357.381 g/mol
Solvent CDCl3
Source File Reference UWLU84858