Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C25H20N2S/c28-25(26-23-17-9-7-15-21(23)19-11-3-1-4-12-19)27-24-18-10-8-16-22(24)20-13-5-2-6-14-20/h1-18H,(H2,26,27,28)
SMILES S=C(Nc1ccccc1c1ccccc1)Nc1ccccc1c1ccccc1
InChI Key OKECALHCRRAAJW-UHFFFAOYSA-N
Molecular Formula C25H20N2S
Exact Mass 380.505 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/OKECALHCRRAAJW-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/OKECALHCRRAAJW-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:34:05.818856
MetadataModified 2024-09-07T15:48:04.162210
MetadataPublished 2019-06-27
Related Molecule
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL9178752 SureChEMBL
19761910 PubChem
The data in this table is sourced from UniChem at EBI.