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3,4-dihydrothio-alpha,alpha,alpha-trifluoro-1(2H)-isoquinolinecarboxy-m-toluidide
SpectraBase Compound ID 6irjwDpM6RN
InChI InChI=1S/C17H15F3N2S/c18-17(19,20)14-6-3-7-15(10-14)21-16(23)22-9-8-12-4-1-2-5-13(12)11-22/h1-7,10H,8-9,11H2,(H,21,23)
InChIKey BFDSCNDZBCODCO-UHFFFAOYSA-N
Mol Weight 336.38 g/mol
Molecular Formula C17H15F3N2S
Exact Mass 336.090804 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FrEtS9wFcDB
Name 3,4-DIHYDROTHIO-alpha,alpha,alpha-TRIFLUORO-2(1H)-ISOQUINOLINECARBOXY-m-TOLUIDIDE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number BTB 1017
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15F3N2S
InChI InChI=1S/C17H15F3N2S/c18-17(19,20)14-6-3-7-15(10-14)21-16(23)22-9-8-12-4-1-2-5-13(12)11-22/h1-7,10H,8-9,11H2,(H,21,23)
InChIKey BFDSCNDZBCODCO-UHFFFAOYSA-N
Melting Point 174C
Molecular Weight 336.381012
Synonyms ISOQUINOLINECARBOXY-M-TOLUIDIDE, 2/1H/-, 3,4-DIHYDROTHIO-A,A,A-TRI- FLUORO-,
Technique KBr WAFER