Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Information

molecular Image
InChI InChI=1S/C8H6O2/c9-5-7-2-1-3-8(4-7)6-10/h1-6H
SMILES O=Cc1cccc(c1)C=O
InChI Key IZALUMVGBVKPJD-UHFFFAOYSA-N
Molecular Formula C8H6O2
Exact Mass 134.132 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IZALUMVGBVKPJD-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/IZALUMVGBVKPJD-UHFFFAOYSA-N/CHMO0001150
Version
Author Grace Hunt
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-08-07
Related Molecule
  • benzene-1,3-dicarbaldehyde
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL2289228 chembl
    180566 surechembl
    34777 pubchem
    LU162B2N9X fdasrs
    IHEMIR CCDC
    106346 brenda
    151176 brenda
    Molport-002-461-872 molport
    The data in this table is sourced from UniChem at EBI.