Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C8H8ClNO3S/c1-6(11)10-7-2-4-8(5-3-7)14(9,12)13/h2-5H,1H3,(H,10,11)
SMILES	CC(=O)Nc1ccc(cc1)S(=O)(=O)Cl
InChI Key	GRDXCFKBQWDAJH-UHFFFAOYSA-N
Molecular Formula	C8H8ClNO3S
Exact Mass	233.672 g/mol

Data and Resources

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Metadata Information

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• Measurement

Field	Value
DOI	10.14272/GRDXCFKBQWDAJH-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/GRDXCFKBQWDAJH-UHFFFAOYSA-N/CHMO0000593
Version
Author	Alex Johnson
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:27:41.674684
MetadataModified	2024-09-08T04:27:41.674690
MetadataPublished	2024-08-08

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables