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/C20H20N4/c1-2-8-14(9-3-1)21-19-16-11-5-4-10-15(16)18-20(23-19)24-13-7-6-12-17(24)22-18/h4-7,10-14H,1-3,8-9H2,(H,21,23)
SMILES C1CCC(CC1)Nc1nc2c(c3c1cccc3)nc1n2cccc1
InChI Key KESLSXGLULXVFT-UHFFFAOYSA-N
Molecular Formula C20H20N4
Exact Mass 316.400 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KESLSXGLULXVFT-UHFFFAOYSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/KESLSXGLULXVFT-UHFFFAOYSA-N/CHMO0000763
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T07:46:49.888285
MetadataModified 2024-09-07T23:34:57.310019
MetadataPublished 2022-09-23
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables