Dataset

infrared absorption spectroscopy (IR)

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

Chemical Info

molecular Image
InChI InChI=1S/C20H12N2/c1-3-14-21-19(8-1)12-10-17-6-5-7-18(16-17)11-13-20-9-2-4-15-22-20/h1-9,14-16H
SMILES c1ccc(nc1)C#Cc1cccc(c1)C#Cc1ccccn1
InChI Key IPGDLMMCGKQFTB-UHFFFAOYSA-N
Molecular Formula C20H12N2
Exact Mass 280.323 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IPGDLMMCGKQFTB-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/IPGDLMMCGKQFTB-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:13:30.079847
MetadataModified 2024-09-07T15:17:29.148377
MetadataPublished 2019-06-27
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables