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3-CHLOROBENZO[b]THIOPHENE-2-CARBOXYLIC ACID, ESTER WITH 2-(p-HYDROXYPHENYL)-3-(alpha,alpha,alpha-TRIFLUORO-p-TOLYL)ACRYLONITRILE
SpectraBase Compound ID El9egBHIfLM
InChI InChI=1S/C25H13ClF3NO2S/c26-22-20-3-1-2-4-21(20)33-23(22)24(31)32-19-11-7-16(8-12-19)17(14-30)13-15-5-9-18(10-6-15)25(27,28)29/h1-13H
InChIKey JHUBCUMULRYVFV-UHFFFAOYSA-N
Mol Weight 483.89 g/mol
Molecular Formula C25H13ClF3NO2S
Exact Mass 483.030762 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ODZx5IM62Y
Name 3-CHLOROBENZO[b]THIOPHENE-2-CARBOXYLIC ACID, ESTER WITH 2-(p-HYDROXYPHENYL)-3-(alpha,alpha,alpha-TRIFLUORO-p-TOLYL)ACRYLONITRILE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H13ClF3NO2S
InChI InChI=1S/C25H13ClF3NO2S/c26-22-20-3-1-2-4-21(20)33-23(22)24(31)32-19-11-7-16(8-12-19)17(14-30)13-15-5-9-18(10-6-15)25(27,28)29/h1-13H
InChIKey JHUBCUMULRYVFV-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 208-210C
Molecular Weight 483.90
Solvent CDCl3; Reference=TMS; Temperature 297K