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BENZOYL-ETHENE-SULFONYL-ACETIC-ACID-METHYLESTER
SpectraBase Compound ID 440sOjEv4fa
InChI InChI=1S/C12H12O5S/c1-17-12(14)9-18(15,16)8-7-11(13)10-5-3-2-4-6-10/h2-8H,9H2,1H3/b8-7+
InChIKey APPSTCNADPKXNG-BQYQJAHWSA-N
Mol Weight 268.28 g/mol
Molecular Formula C12H12O5S
Exact Mass 268.040545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7806UkIycP
Name BENZOYL-ETHENE-SULFONYL-ACETIC-ACID-METHYLESTER
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O5S
InChI InChI=1S/C12H12O5S/c1-17-12(14)9-18(15,16)8-7-11(13)10-5-3-2-4-6-10/h2-8H,9H2,1H3/b8-7+
InChIKey APPSTCNADPKXNG-BQYQJAHWSA-N
Literature Reference Author V.PADMAVATHI,A.V.N.MOHAN,K.MAHESH,A.PADMAJA
Literature Reference Citation CHEM.PHARM.BULL.,56,815(2008)
Literature Reference DOI 10.1248/cpb.56.815
Molecular Weight 268.284 g/mol
Sample ID 1772
Solvent CDCl3