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4-AMINO-N-(3,4-DIMETHOXYPHENETHYL)-5-(p-FLUOROBENZOYL)-2-(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)-3-THIOPHENECARBOXAMIDE

View entire compound with spectra: 1 NMR, and 1 FTIR

4-AMINO-N-(3,4-DIMETHOXYPHENETHYL)-5-(p-FLUOROBENZOYL)-2-(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)-3-THIOPHENECARBOXAMIDE
SpectraBase Compound ID EZw079QmgHI
InChI InChI=1S/C29H25F4N3O4S/c1-39-21-11-6-16(14-22(21)40-2)12-13-35-27(38)23-24(34)26(25(37)17-7-9-19(30)10-8-17)41-28(23)36-20-5-3-4-18(15-20)29(31,32)33/h3-11,14-15,36H,12-13,34H2,1-2H3,(H,35,38)
InChIKey DHZRFWZOECWSCS-UHFFFAOYSA-N
Mol Weight 587.59 g/mol
Molecular Formula C29H25F4N3O4S
Exact Mass 587.15019 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ExKdcAuvP3I
Name 4-AMINO-N-(3,4-DIMETHOXYPHENETHYL)-5-(p-FLUOROBENZOYL)-2-(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)-3-THIOPHENECARBOXAMIDE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number CD 784
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H25F4N3O4S
InChI InChI=1S/C29H25F4N3O4S/c1-39-21-11-6-16(14-22(21)40-2)12-13-35-27(38)23-24(34)26(25(37)17-7-9-19(30)10-8-17)41-28(23)36-20-5-3-4-18(15-20)29(31,32)33/h3-11,14-15,36H,12-13,34H2,1-2H3,(H,35,38)
InChIKey DHZRFWZOECWSCS-UHFFFAOYSA-N
Melting Point 163-165C
Molecular Weight 587.596008
Synonyms 3-THIOPHENECARBOXAMIDE, 4-AMINO- N-/3,4-DIMETHOXYPHENETHYL/-5-/P-FLUORO BENZOYL/-2-/A,A,A-TRIFLUORO- M-TOLUIDINO/-,
Technique KBr WAFER