Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C24H24Br2/c1-13-7-20(22-10-18(6)24(26)12-16(22)4)14(2)8-19(13)21-9-17(5)23(25)11-15(21)3/h7-12H,1-6H3
SMILES Cc1cc(c(cc1c1cc(C)c(cc1C)Br)C)c1cc(C)c(cc1C)Br
InChI Key GFKHYMZMLDLPTF-UHFFFAOYSA-N
Molecular Formula C24H24Br2
Exact Mass 472.255 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GFKHYMZMLDLPTF-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/GFKHYMZMLDLPTF-UHFFFAOYSA-N/IR
Version
Author Sylvain Grosjean
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:34:30.525340
MetadataModified 2024-09-07T11:54:10.891597
MetadataPublished 2014-05-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL14866666 SureChEMBL
73427253 PubChem
The data in this table is sourced from UniChem at EBI.