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1-(PARA-ETHOXYPHENYL)-2-[2-(3-CHLORO-BENZO-[B]-THIENYL)]-(4E)-(ACETIC-ACID-ETHYLIDENE)-2-IMIDAZOLIN-5-ONE
SpectraBase Compound ID ByP8wIKJlGL
InChI InChI=1S/C27H19ClN2O4S/c1-2-34-19-13-11-18(12-14-19)30-25(24-23(28)20-5-3-4-6-22(20)35-24)29-21(26(30)31)15-16-7-9-17(10-8-16)27(32)33/h3-15H,2H2,1H3,(H,32,33)/b21-15-
InChIKey NCJRDEIGMHENFS-QNGOZBTKSA-N
Mol Weight 502.97 g/mol
Molecular Formula C27H19ClN2O4S
Exact Mass 502.075406 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D3ZD8pza7zr
Name 1-(PARA-ETHOXYPHENYL)-2-[2-(3-CHLORO-BENZO-[B]-THIENYL)]-(4E)-(ACETIC-ACID-ETHYLIDENE)-2-IMIDAZOLIN-5-ONE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H19ClN2O4S
InChI InChI=1S/C27H19ClN2O4S/c1-2-34-19-13-11-18(12-14-19)30-25(24-23(28)20-5-3-4-6-22(20)35-24)29-21(26(30)31)15-16-7-9-17(10-8-16)27(32)33/h3-15H,2H2,1H3,(H,32,33)/b21-15-
InChIKey NCJRDEIGMHENFS-QNGOZBTKSA-N
Literature Reference Author K.LAIHIA,E.KOLEHMAINEN,V.NIKIFOROV,S.MILTSOV
Literature Reference Citation MAGN.RES.CHEM.,44,895(2006)
Literature Reference DOI 10.1002/mrc.1862
Solvent DMSO-D6
Source File Reference UWLU63455