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/C19H20N4O2/c1-11(2)20-18-13-10-15(25-4)14(24-3)9-12(13)17-19(22-18)23-8-6-5-7-16(23)21-17/h5-11H,1-4H3,(H,20,22)
SMILES COc1cc2c(NC(C)C)nc3c(c2cc1OC)nc1n3cccc1
InChI Key VJUXHPAAXFEYKZ-UHFFFAOYSA-N
Molecular Formula C19H20N4O2
Exact Mass 336.388 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VJUXHPAAXFEYKZ-UHFFFAOYSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/VJUXHPAAXFEYKZ-UHFFFAOYSA-N/CHMO0000763
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T08:14:54.656501
MetadataModified 2024-09-08T00:11:47.069416
MetadataPublished 2023-01-23
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
166451855 PubChem
The data in this table is sourced from UniChem at EBI.