1H nuclear magnetic resonance spectroscopy (1H NMR)

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The Chemotion Repository contains various analytical data of molecules like NMR, MS, IR or UV Spectra. Chemotion (as of May 2022) contains 9719 analytical datasets (3930 NMR,...

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Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image

InChI	InChI=1S/C5H3BrO2S/c6-4-2-1-3(9-4)5(7)8/h1-2H,(H,7,8)
SMILES	OC(=O)c1ccc(s1)Br
InChI Key	COWZPSUDTMGBAT-UHFFFAOYSA-N
Molecular Formula	C5H3BrO2S
Exact Mass	207.045 g/mol

Data and Resources

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

Field	Value
DOI	10.14272/COWZPSUDTMGBAT-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/COWZPSUDTMGBAT-UHFFFAOYSA-N/CHMO0000593
Version
Author	Grace Hunt
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:14:13.198999
MetadataModified	2024-09-08T04:14:13.199004
MetadataPublished	2024-07-16

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