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/C16H17BrN4/c1-16(2,3)20-15-14(11-6-4-5-7-12(11)17)19-13-10-18-8-9-21(13)15/h4-10,20H,1-3H3
SMILES Brc1ccccc1c1nc2n(c1NC(C)(C)C)ccnc2
InChI Key FDKYXFKVWISCIL-UHFFFAOYSA-N
Molecular Formula C16H17BrN4
Exact Mass 345.237 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FDKYXFKVWISCIL-UHFFFAOYSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/FDKYXFKVWISCIL-UHFFFAOYSA-N/CHMO0000763
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T08:19:23.147651
MetadataModified 2024-09-08T00:17:35.498080
MetadataPublished 2023-01-23
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables