Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C10H20O/c1-2-3-4-5-7-10-8-6-9-11-10/h10H,2-9H2,1H3
SMILES CCCCCCC1CCCO1
InChI Key PFCMQIWQXUAYPK-UHFFFAOYSA-N
Molecular Formula C10H20O
Exact Mass 156.265 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PFCMQIWQXUAYPK-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/PFCMQIWQXUAYPK-UHFFFAOYSA-N/CHMO0000470
Version
Author Vanessa Koch
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-21
Related Molecule
  • 2-hexyloxolane
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL409221 SureChEMBL
    4316284 eMolecules
    551183 PubChem
    15561070 PubChem: Thomson Pharma
    J953.628K Nikkaji
    The data in this table is sourced from UniChem at EBI.