Dataset

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C17H16N4/c1-11(2)18-16-13-8-4-3-7-12(13)15-17(20-16)21-10-6-5-9-14(21)19-15/h3-11H,1-2H3,(H,18,20)
SMILES CC(Nc1nc2c(c3c1cccc3)nc1n2cccc1)C
InChI Key NNQKMYYBCPGPGY-UHFFFAOYSA-N
Molecular Formula C17H16N4
Exact Mass 276.336 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NNQKMYYBCPGPGY-UHFFFAOYSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/NNQKMYYBCPGPGY-UHFFFAOYSA-N/CHMO0000763
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:24:09.642655
MetadataModified 2024-09-07T22:02:09.393596
MetadataPublished 2022-04-16
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables