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5-AMINO-4-[2'-PHENYLSULFONYL-1'-(4-CHLOROPHENYL)-ETHYL]-PYRAZOL-3-ONE
SpectraBase Compound ID J9MoQX9OHpy
InChI InChI=1S/C17H16ClN3O3S/c18-12-8-6-11(7-9-12)14(15-16(19)20-21-17(15)22)10-25(23,24)13-4-2-1-3-5-13/h1-9,14-15H,10H2,(H2,19,20)(H,21,22)
InChIKey YUYSOXUXLXORKI-UHFFFAOYSA-N
Mol Weight 377.85 g/mol
Molecular Formula C17H16ClN3O3S
Exact Mass 377.06009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9RqV5lUfsck
Name 5-AMINO-4-[2'-PHENYLSULFONYL-1'-(4-CHLOROPHENYL)-ETHYL]-PYRAZOL-3-ONE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16ClN3O3S
InChI InChI=1S/C17H16ClN3O3S/c18-12-8-6-11(7-9-12)14(15-16(19)20-21-17(15)22)10-25(23,24)13-4-2-1-3-5-13/h1-9,14-15H,10H2,(H2,19,20)(H,21,22)
InChIKey YUYSOXUXLXORKI-UHFFFAOYSA-N
Literature Reference Author V.PADMAVATHI,D.R.C.V.SUBBAIAH,K.MAHESH,T.R.LAKSHMI
Literature Reference Citation CHEM.PHARM.BULL.,55,1704(2007)
Literature Reference DOI 10.1248/cpb.55.1704
Molecular Weight 377.845 g/mol
Sample ID 56016
Solvent CDCl3