Dataset

2-UNDECANOL; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP006864 contains the MS mass spectrum of 2-UNDECANOL with the InChIkey XMUJIPOFTAHSOK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H24O/c1-3-4-5-6-7-8-9-10-11(2)12/h11-12H,3-10H2,1-2H3
SMILES CCCCCCCCCC(C)O
InChI Key XMUJIPOFTAHSOK-UHFFFAOYSA-N
Molecular Formula C11H24O
Exact Mass 172.183 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP006864
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • undecan-2-ol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:77930 chebi
    LMFA05000621 lipidmaps
    CHEMBL4633278 chembl
    378851 surechembl
    15448 pubchem
    49PCZ1S7LY fdasrs
    PD087957 probes_and_drugs
    HMDB0030942 hmdb
    Molport-001-783-215 molport
    The data in this table is sourced from UniChem at EBI.