Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C7H14O2/c8-5-1-3-7-4-2-6-9-7/h7-8H,1-6H2
SMILES OCCCC1CCCO1
InChI Key XVYHFICIWQBZDI-UHFFFAOYSA-N
Molecular Formula C7H14O2
Exact Mass 130.185 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XVYHFICIWQBZDI-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/XVYHFICIWQBZDI-UHFFFAOYSA-N/CHMO0000595
Version
Author Vanessa Koch
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-21
Related Molecule
  • 3-(oxolan-2-yl)propan-1-ol
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    970008 surechembl
    13020 pubchem
    N3US524V7P fdasrs
    Molport-001-782-620 molport
    The data in this table is sourced from UniChem at EBI.