Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C11H13BrO2/c1-6(2)10-8(5-13)11(14)7(3)4-9(10)12/h4-6,14H,1-3H3
SMILES O=Cc1c(O)c(C)cc(c1C(C)C)Br
InChI Key HKSXVOUAEWPBKY-UHFFFAOYSA-N
Molecular Formula C11H13BrO2
Exact Mass 257.124 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HKSXVOUAEWPBKY-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/HKSXVOUAEWPBKY-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:17:05.941105
MetadataModified 2024-09-07T15:22:49.484994
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables