Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C16H16O4/c1-11-4-9-14(15(10-11)18-2)20-13-7-5-12(6-8-13)16(17)19-3/h4-10H,1-3H3
SMILES COC(=O)c1ccc(cc1)Oc1ccc(cc1OC)C
InChI Key MFKBBLHMVNUYBZ-UHFFFAOYSA-N
Molecular Formula C16H16O4
Exact Mass 272.296 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MFKBBLHMVNUYBZ-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5
License URL
Source https://www.chemotion-repository.net/inchikey/MFKBBLHMVNUYBZ-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5
Version
Author Nicole Jung
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • methyl 4-(2-methoxy-4-methylphenoxy)benzoate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    73427442 pubchem
    The data in this table is sourced from UniChem at EBI.