Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C11H9N5O2/c17-10-6-16(15-14-10)5-9-11(18)13-8-4-2-1-3-7(8)12-9/h1-4,6,17H,5H2,(H,13,18)
SMILES Oc1nnn(c1)Cc1nc2ccccc2[nH]c1=O
InChI Key ZRWWUXPKUJWJNV-UHFFFAOYSA-N
Molecular Formula C11H9N5O2
Exact Mass 243.221 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZRWWUXPKUJWJNV-UHFFFAOYSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/ZRWWUXPKUJWJNV-UHFFFAOYSA-N/IR
Version
Author Yu-Chieh Huang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T01:34:10.727809
MetadataModified 2024-09-07T15:48:11.216392
MetadataPublished 2019-06-27
Related Molecule
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
No additional information available for this Dataset.