Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

InChI	InChI=1S/C14H14O3S/c1-11-3-7-13(8-4-11)18(15,16)14-9-5-12(17-2)6-10-14/h3-10H,1-2H3
SMILES	COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C
InChI Key	RHZGFTNGGQAHIQ-UHFFFAOYSA-N
Exact Mass	262.324 g/mol

Data and Resources

• 1H nuclear magnetic resonance spectroscopy (1H NMR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/RHZGFTNGGQAHIQ-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/RHZGFTNGGQAHIQ-UHFFFAOYSA-N/CHMO0000593
Version
Author	José Carlos Ferreira da Cunha
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2026-01-20
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables	title : Sep18-2024-braese date : 20240919 starting time : 1.08 h label : JFC-74 id : 325665 Solvent : chloroform-D1 (CDCl3) temperature : 298.0 K PULPROG : zg30 number of scans : 16 scans instrument : spect

Data-Source Molecule ID	Data-Source
825670	surechembl
11139925	pubchem
The data in this table is sourced from UniChem at EBI.