Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C18H14O6/c1-23-17(21)13-7-3-5-11(9-13)15(19)16(20)12-6-4-8-14(10-12)18(22)24-2/h3-10H,1-2H3
SMILES COC(=O)c1cccc(c1)C(=O)C(=O)c1cccc(c1)C(=O)OC
InChI Key QEPVMXNPUMUHDF-UHFFFAOYSA-N
Molecular Formula C18H14O6
Exact Mass 326.300 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QEPVMXNPUMUHDF-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/QEPVMXNPUMUHDF-UHFFFAOYSA-N/CHMO0000595
Version
Author Simon Oßwald
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-04-07
Related Molecule
  • methyl 3-[2-(3-methoxycarbonylphenyl)-2-oxoacetyl]benzoate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    101810264 PubChem
    J2.973.685E Nikkaji
    The data in this table is sourced from UniChem at EBI.