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[3-(4-CHLORO-BENZOYL)-4,5-DIHYDRO-1H-PYRAZOLE-4-SULFONYL]-ACETIC-ACID-METHYLESTER
SpectraBase Compound ID EBSK7MGC64V
InChI InChI=1S/C13H13ClN2O5S/c1-21-11(17)7-22(19,20)10-6-15-16-12(10)13(18)8-2-4-9(14)5-3-8/h2-5,10,15H,6-7H2,1H3
InChIKey SEAQGUSPXIOIQO-UHFFFAOYSA-N
Mol Weight 344.77 g/mol
Molecular Formula C13H13ClN2O5S
Exact Mass 344.02337 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gbr9Z4szbSU
Name [3-(4-CHLORO-BENZOYL)-4,5-DIHYDRO-1H-PYRAZOLE-4-SULFONYL]-ACETIC-ACID-METHYLESTER
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13ClN2O5S
InChI InChI=1S/C13H13ClN2O5S/c1-21-11(17)7-22(19,20)10-6-15-16-12(10)13(18)8-2-4-9(14)5-3-8/h2-5,10,15H,6-7H2,1H3
InChIKey SEAQGUSPXIOIQO-UHFFFAOYSA-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 344.770 g/mol
Sample ID 1783
Solvent CDCl3