Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C10H12O2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6,10H,4,7-8H2
SMILES C1COC(OC1)c1ccccc1
InChI Key LNEMDIUSUQPKIP-UHFFFAOYSA-N
Molecular Formula C10H12O2
Exact Mass 164.201 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LNEMDIUSUQPKIP-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/LNEMDIUSUQPKIP-UHFFFAOYSA-N/CHMO0000595
Version
Author Vanessa Koch
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-21
Related Molecule
  • 2-phenyl-1,3-dioxane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    733501 surechembl
    69874 pubchem
    A70K3QI3S7 fdasrs
    Molport-001-914-450 molport
    The data in this table is sourced from UniChem at EBI.