Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)

Chemical Information

molecular Image
InChI InChI=1S/C10H16N6/c1-7(2)16(8(3)4)15-14-10-9(5-11)6-12-13-10/h6-8H,1-4H3,(H,12,13)/b15-14+
SMILES CC(N(C(C)C)/N=N/c1n[nH]cc1C#N)C
InChI Key UCPMQTTXXMXIFF-CCEZHUSRSA-N
Molecular Formula C10H16N6
Exact Mass 220.274 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UCPMQTTXXMXIFF-CCEZHUSRSA-N/IR
License URL
Source https://www.chemotion-repository.net/inchikey/UCPMQTTXXMXIFF-CCEZHUSRSA-N/IR
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-02-19
Related Molecule
  • 5-[(~{E})-[di(propan-2-yl)amino]diazenyl]-1~{H}-pyrazole-4-carbonitrile
    • Field Value
    Measurement Technique infrared absorption spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    137333328 PubChem
    The data in this table is sourced from UniChem at EBI.