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/C6H4N2Se/c1-2-4-6-5(3-1)7-9-8-6/h1-4H
SMILES c1ccc2c(c1)n[se]n2
InChI Key AYTPIVIDHMVGSX-UHFFFAOYSA-N
Molecular Formula C6H4N2Se
Exact Mass 183.069 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AYTPIVIDHMVGSX-UHFFFAOYSA-N/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/AYTPIVIDHMVGSX-UHFFFAOYSA-N/CHMO0000763
Version
Author Valentina Ferraro
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T04:16:02.664835
MetadataModified 2024-09-08T04:16:02.664841
MetadataPublished 2024-07-23
Field Value
Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
67503 PubChem
534891 eMolecules
273-15-4 ACToR
44Z4759EKU FDA SRS
DTXSID60181743 EPA CompTox Dashboard
104171897 PubChem: Thomson Pharma
J99.481B Nikkaji
BESEAZ CCDC
SCHEMBL766609 SureChEMBL
10016251 NMRShiftDB
MCULE-1218109825 Mcule
CB1928707 ChemicalBook
The data in this table is sourced from UniChem at EBI.