Dataset

Fourier transform infrared spectroscopy (FTIR)

dataset for Fourier transform infrared spectroscopy (FTIR)

Chemical Information

molecular Image
InChI InChI=1S/C11H12N6O2/c1-19-9-4-2-8(3-5-9)7-12-15-11(18)6-10-13-16-17-14-10/h2-5,7H,6H2,1H3,(H,15,18)(H,13,14,16,17)/b12-7+
SMILES COc1ccc(cc1)/C=N/NC(=O)Cc1nnn[nH]1
InChI Key MZMWXNCBDICVDV-KPKJPENVSA-N
Molecular Formula C11H12N6O2
Exact Mass 260.252 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MZMWXNCBDICVDV-KPKJPENVSA-N/CHMO0000636
License URL
Source https://www.chemotion-repository.net/inchikey/MZMWXNCBDICVDV-KPKJPENVSA-N/CHMO0000636
Version
Author Andreas Link
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-05-22
Related Molecule
  • N-[(E)-(4-methoxyphenyl)methylideneamino]-2-(2H-tetrazol-5-yl)acetamide
    • Field Value
    Measurement Technique Fourier transform infrared spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    ZINC000006736415 ZINC
    168059111 PubChem
    The data in this table is sourced from UniChem at EBI.