1H nuclear magnetic resonance spectroscopy (1H NMR)

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Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image

InChI	InChI=1S/C10H9BrO4/c1-14-9(12)6-4-3-5-7(8(6)11)10(13)15-2/h3-5H,1-2H3
SMILES	COC(=O)c1cccc(c1Br)C(=O)OC
InChI Key	GHPOMFOMBISJGM-UHFFFAOYSA-N
Exact Mass	273.080 g/mol

Data and Resources

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

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Metadata Information

Field	Value
DOI	10.14272/GHPOMFOMBISJGM-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/GHPOMFOMBISJGM-UHFFFAOYSA-N/CHMO0000593
Version
Author	Janine Haug
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-09-16
Related Molecule

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

Data-Source Molecule ID	Data-Source
12699360	PubChem
J3.158.914B	Nikkaji
ZINC000095933564	ZINC
CB72705173	ChemicalBook
SCHEMBL987813	SureChEMBL
The data in this table is sourced from UniChem at EBI.