Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C10H8BrN3O3/c1-17-9(15)5-14-10(16)7-4-6(11)2-3-8(7)12-13-14/h2-4H,5H2,1H3
SMILES COC(=O)Cn1nnc2c(c1=O)cc(cc2)Br
InChI Key UZLGFYPXFKDTNC-UHFFFAOYSA-N
Molecular Formula C10H8BrN3O3
Exact Mass 298.093 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UZLGFYPXFKDTNC-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1
License URL
Source https://www.chemotion-repository.net/inchikey/UZLGFYPXFKDTNC-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-09-23
Related Molecule
  • methyl 2-(6-bromo-4-oxo-1,2,3-benzotriazin-3-yl)acetate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    13442350 pubchem
    The data in this table is sourced from UniChem at EBI.