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4-CHLORO-BENZOYL-ETHENE-MERCAPTO-ACETIC-ACID

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4-CHLORO-BENZOYL-ETHENE-MERCAPTO-ACETIC-ACID
SpectraBase Compound ID Ak3ReA0KPbX
InChI InChI=1S/C11H9ClO3S/c12-9-3-1-8(2-4-9)10(13)5-6-16-7-11(14)15/h1-6H,7H2,(H,14,15)/b6-5+
InChIKey BHWIDZUIUMCGBY-AATRIKPKSA-N
Mol Weight 256.7 g/mol
Molecular Formula C11H9ClO3S
Exact Mass 255.996093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7aUGnUxQgbQ
Name 4-CHLORO-BENZOYL-ETHENE-MERCAPTO-ACETIC-ACID
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9ClO3S
InChI InChI=1S/C11H9ClO3S/c12-9-3-1-8(2-4-9)10(13)5-6-16-7-11(14)15/h1-6H,7H2,(H,14,15)/b6-5+
InChIKey BHWIDZUIUMCGBY-AATRIKPKSA-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 256.704 g/mol
Sample ID 1768
Solvent CDCl3