Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C30H27Br2N3O2/c1-2-37-30(36)29-13-18(24-16-33-26-10-8-19(31)14-22(24)26)12-28(35(29)21-6-4-3-5-7-21)25-17-34-27-11-9-20(32)15-23(25)27/h3-11,14-18,28-29,33-34H,2,12-13H2,1H3/t18-,28-,29-/m0/s1
SMILES CCOC(=O)[C@@H]1C[C@H](C[C@H](N1c1ccccc1)c1c[nH]c2c1cc(Br)cc2)c1c[nH]c2c1cc(Br)cc2
InChI Key KUXKKDAIRKVURS-AFMHLJNQSA-N
Molecular Formula C30H27Br2N3O2
Exact Mass 621.362 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KUXKKDAIRKVURS-AFMHLJNQSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/KUXKKDAIRKVURS-AFMHLJNQSA-N/IR
Version
Author Sabilla Zhong
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T23:46:17.867447
MetadataModified 2024-09-07T13:05:40.302711
MetadataPublished 2014-05-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables