Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C19H19BrO2/c1-2-22-19(21)17-11-13-3-4-14-6-8-16(18(20)12-14)10-9-15(17)7-5-13/h5-8,11-12H,2-4,9-10H2,1H3
SMILES	CCOC(=O)c1cc2ccc1CCc1ccc(CC2)cc1Br
InChI Key	OKRBGPAUBMWMCI-UHFFFAOYSA-N
Molecular Formula	C19H19BrO2
Exact Mass	359.257 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/OKRBGPAUBMWMCI-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/OKRBGPAUBMWMCI-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:22:25.138657
MetadataModified	2024-09-07T15:30:38.442862
MetadataPublished	2019-06-27

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
138453613	PubChem
The data in this table is sourced from UniChem at EBI.