Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C15H16O5/c1-19-14(17)12-7-8-13(15(18)20-2)11(10-12)6-4-3-5-9-16/h7-8,10,16H,3,5,9H2,1-2H3
SMILES COC(=O)c1ccc(cc1C#CCCCO)C(=O)OC
InChI Key YPLVDFDRCDRLFB-UHFFFAOYSA-N
Molecular Formula C15H16O5
Exact Mass 276.285 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YPLVDFDRCDRLFB-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/YPLVDFDRCDRLFB-UHFFFAOYSA-N/CHMO0000595
Version
Author Irina Balova
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-02-16
Related Molecule
  • dimethyl 2-(5-hydroxypent-1-ynyl)benzene-1,4-dicarboxylate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    166625042 PubChem
    The data in this table is sourced from UniChem at EBI.