Dataset

infrared absorption spectroscopy (IR)

Chemical Info

InChI	InChI=1S/C10H8BrN/c1-2-7-6-12-10-4-3-8(11)5-9(7)10/h2-6,12H,1H2
SMILES	C=Cc1c[nH]c2c1cc(Br)cc2
InChI Key	KRVXBECJUSODAH-UHFFFAOYSA-N
Molecular Formula	C10H8BrN
Exact Mass	222.081 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/KRVXBECJUSODAH-UHFFFAOYSA-N/IR
License URL
Source	https://www.chemotion-repository.net/inchikey/KRVXBECJUSODAH-UHFFFAOYSA-N/IR
Version
Author	Yu-Chieh Huang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T01:13:48.028406
MetadataModified	2024-09-07T15:17:55.513180
MetadataPublished	2019-06-27
Related Molecule

Field	Value
Measurement Technique	infrared absorption spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
119082622	PubChem
The data in this table is sourced from UniChem at EBI.