Dataset

N-UNDECYL CYANIDE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008318 contains the MS mass spectrum of N-UNDECYL CYANIDE with the InChIkey VXCUURYYWGCLIH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-11H2,1H3
SMILES CCCCCCCCCCCC#N
InChI Key VXCUURYYWGCLIH-UHFFFAOYSA-N
Molecular Formula C12H23N
Exact Mass 181.183 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-JP008318
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • dodecanenitrile
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:189391 chebi
    LMFA09000003 lipidmaps
    CHEMBL1879602 chembl
    181303 surechembl
    17092 pubchem
    TL45I6761P fdasrs
    Molport-001-785-586 molport
    The data in this table is sourced from UniChem at EBI.