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DCLAXUOVEZXKNK-UHFFFAOYSA-N
SpectraBase Compound ID GVFDnRtuEaA
InChI InChI=1S/C22H17N3O4S/c1-2-29-22(26)21-19(15-10-12-17(13-11-15)25(27)28)20(18-9-6-14-30-18)23-24(21)16-7-4-3-5-8-16/h3-14H,2H2,1H3
InChIKey DCLAXUOVEZXKNK-UHFFFAOYSA-N
Mol Weight 419.46 g/mol
Molecular Formula C22H17N3O4S
Exact Mass 419.093977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KeAYYIFvFLQ
Name 5-ETHOXYCARBONYL-4-PARA-NITROPHENYL-1-PHENYL-3-(2'-THIENYL)-PYRAZOLE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H17N3O4S
InChI InChI=1S/C22H17N3O4S/c1-2-29-22(26)21-19(15-10-12-17(13-11-15)25(27)28)20(18-9-6-14-30-18)23-24(21)16-7-4-3-5-8-16/h3-14H,2H2,1H3
InChIKey DCLAXUOVEZXKNK-UHFFFAOYSA-N
Literature Reference Author H.M.HASSANEEN,H.A.H.MOUSA,S.T.EZMIRLY,A.S.SHAWALI
Literature Reference Citation CAN.J.CHEM.,66,1386(1988)
Literature Reference DOI 10.1139/v88-224
Molecular Weight 419.455 g/mol
Solvent CDCl3
Source File Reference UWED5378