Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C26H30BrN/c1-25(2,3)19-7-13-22(14-8-19)28(24-17-11-21(27)12-18-24)23-15-9-20(10-16-23)26(4,5)6/h7-18H,1-6H3
SMILES Brc1ccc(cc1)N(c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C
InChI Key NPGGLZWVRNBLFX-UHFFFAOYSA-N
Molecular Formula C26H30BrN
Exact Mass 436.427 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NPGGLZWVRNBLFX-UHFFFAOYSA-N/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/NPGGLZWVRNBLFX-UHFFFAOYSA-N/CHMO0000630
Version
Author Steffen Otterbach
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-11-13
Related Molecule
  • N-(4-bromophenyl)-4-tert-butyl-N-(4-tert-butylphenyl)aniline
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    9956810 surechembl
    59793446 pubchem
    Molport-049-216-175 molport
    The data in this table is sourced from UniChem at EBI.