For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

benzo[b]thiophene-2-carboxylic acid, 2-bromo-4-(1,3-dithiolan-2-yl)-6-methoxyphenyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

benzo[b]thiophene-2-carboxylic acid, 2-bromo-4-(1,3-dithiolan-2-yl)-6-methoxyphenyl ester
SpectraBase Compound ID 4JqeEfXoeXq
InChI InChI=1S/C19H15BrO3S3/c1-22-14-9-12(19-24-6-7-25-19)8-13(20)17(14)23-18(21)16-10-11-4-2-3-5-15(11)26-16/h2-5,8-10,19H,6-7H2,1H3
InChIKey UGSMDUZEJAMSEF-UHFFFAOYSA-N
Mol Weight 467.41 g/mol
Molecular Formula C19H15BrO3S3
Exact Mass 465.936671 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5ppbIfkhh0I
Name BENZO[b]THIOPHENE-2-CARBOXYLIC ACID, 2-BROMO-4-(1,3-DITHIOLAN-2-YL)-6-METHOXYPHENYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15BrO3S3
InChI InChI=1S/C19H15BrO3S3/c1-22-14-9-12(19-24-6-7-25-19)8-13(20)17(14)23-18(21)16-10-11-4-2-3-5-15(11)26-16/h2-5,8-10,19H,6-7H2,1H3
InChIKey UGSMDUZEJAMSEF-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 153-155C
Molecular Weight 467.43
Solvent CDCl3; Reference=TMS; Temperature 297K