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3-hydroxybenzo[b]thiophene-2-carboxylic acid, 2-phenoxynicotinate
SpectraBase Compound ID 8nVTNqre1PQ
InChI InChI=1S/C22H15NO5S/c1-26-22(25)19-18(15-10-5-6-12-17(15)29-19)28-21(24)16-11-7-13-23-20(16)27-14-8-3-2-4-9-14/h2-13H,1H3
InChIKey RPHXOZJXMHWOMD-UHFFFAOYSA-N
Mol Weight 405.42 g/mol
Molecular Formula C22H15NO5S
Exact Mass 405.067094 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FAuCG6NsAvk
Name 3-HYDROXYBENZO[b]THIOPHENE-2-CARBOXYLIC ACID, METHYL ESTER, 2-PHENOXYNICOTINATE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number BTB 5269
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15NO5S
InChI InChI=1S/C22H15NO5S/c1-26-22(25)19-18(15-10-5-6-12-17(15)29-19)28-21(24)16-11-7-13-23-20(16)27-14-8-3-2-4-9-14/h2-13H,1H3
InChIKey RPHXOZJXMHWOMD-UHFFFAOYSA-N
Melting Point 175-177C
Molecular Weight 405.424011
Synonyms BENZO/B/THIOPHENE-2-CARBOXYLIC ACID, 3-HYDROXY-, 2-PHENOXYNICOTINATE
Technique KBr WAFER