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

*Links on SpectraBase are not permalinks.
m-MERCAPTOBENZOIC ACID, ETHYL ESTER, p-ISOTHIOCYANATOBENZENESULFONATE
SpectraBase Compound ID FYKKbsEz9Ua
InChI InChI=1S/C16H13NO4S3/c1-2-21-16(18)12-4-3-5-14(10-12)23-24(19,20)15-8-6-13(7-9-15)17-11-22/h3-10H,2H2,1H3
InChIKey CQOIITWXTOOFTL-UHFFFAOYSA-N
Mol Weight 379.46 g/mol
Molecular Formula C16H13NO4S3
Exact Mass 379.000671 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 3p5Kj2H2mWA
Name m-MERCAPTOBENZOIC ACID, ETHYL ESTER, p-ISOTHIOCYANATOBENZENESULFONATE
Source of Sample E. Vinkler, Medical University of Szeged, Szeged, Hungary
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO4S3
InChI InChI=1S/C16H13NO4S3/c1-2-21-16(18)12-4-3-5-14(10-12)23-24(19,20)15-8-6-13(7-9-15)17-11-22/h3-10H,2H2,1H3
InChIKey CQOIITWXTOOFTL-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 69, 18773(1968)
Melting Point 65.5C
Molecular Weight 379.463013
Synonyms BENZOIC ACID, M-MERCAPTO-, ETHYL ESTER, P-ISOTHIOCYANATOTHIOBENZENE- SULFONATE
Technique CAPILLARY CELL: MELT