Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C10H11BrO3/c1-13-9-4-3-7(8(12)6-11)5-10(9)14-2/h3-5H,6H2,1-2H3
SMILES	BrCC(=O)c1ccc(c(c1)OC)OC
InChI Key	NUAIPKMBWNVQIM-UHFFFAOYSA-N
Molecular Formula	C10H11BrO3
Exact Mass	259.097 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/NUAIPKMBWNVQIM-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/NUAIPKMBWNVQIM-UHFFFAOYSA-N/CHMO0000470
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:30:24.746645
MetadataModified	2024-09-08T04:30:24.746650
MetadataPublished	2024-08-15

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables