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[3-(4-CHLORO-PHENYL)-4,5-DIHYDRO-1H-PYRAZOLE-5-SULFONYL]-ACETIC-ACID-METHYLESTER
SpectraBase Compound ID EwyXetdj54h
InChI InChI=1S/C12H13ClN2O4S/c1-19-12(16)7-20(17,18)11-6-10(14-15-11)8-2-4-9(13)5-3-8/h2-5,11,15H,6-7H2,1H3
InChIKey CLVSIBSLDMFHCT-UHFFFAOYSA-N
Mol Weight 316.76 g/mol
Molecular Formula C12H13ClN2O4S
Exact Mass 316.028456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8AhB9cac0PD
Name [3-(4-CHLORO-PHENYL)-4,5-DIHYDRO-1H-PYRAZOLE-5-SULFONYL]-ACETIC-ACID-METHYLESTER
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13ClN2O4S
InChI InChI=1S/C12H13ClN2O4S/c1-19-12(16)7-20(17,18)11-6-10(14-15-11)8-2-4-9(13)5-3-8/h2-5,11,15H,6-7H2,1H3
InChIKey CLVSIBSLDMFHCT-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 316.759 g/mol
Sample ID 1780
Solvent CDCl3