Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C9H10Br2O/c1-6(12-2)8-5-7(10)3-4-9(8)11/h3-6H,1-2H3/t6-/m0/s1
SMILES	C[C@@H](c1cc(Br)ccc1Br)OC
InChI Key	RNLYINNBMKDNJK-LURJTMIESA-N
Molecular Formula	C9H10Br2O
Exact Mass	293.983 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/RNLYINNBMKDNJK-LURJTMIESA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/RNLYINNBMKDNJK-LURJTMIESA-N/CHMO0000593
Version
Author	Christoph Zippel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:56:48.821998
MetadataModified	2024-09-07T16:20:07.209802
MetadataPublished	2020-01-03
Related Molecule

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

Data-Source Molecule ID	Data-Source
145721701	PubChem
The data in this table is sourced from UniChem at EBI.