Dataset

Hexanamide; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01061903 contains the MS2 mass spectrum of Hexanamide with the InChIkey ALBYIUDWACNRRB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H13NO/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H2,7,8)
SMILES CCCCCC(=O)N
InChI Key ALBYIUDWACNRRB-UHFFFAOYSA-N
Molecular Formula C6H13NO
Exact Mass 115.100 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01061903
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Maintainer
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MetadataPublished 2024-06-14
Related Molecule
  • hexanamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:142683 chebi
    CHEMBL1523958 chembl
    1427358 surechembl
    9392 surechembl
    12332 pubchem
    R0YX4OJ6TW fdasrs
    PD014791 probes_and_drugs
    ZZZLXS CCDC
    126358 brenda
    132721 brenda
    13602 brenda
    20174 brenda
    5775 brenda
    97461 brenda
    Molport-001-783-809 molport
    The data in this table is sourced from UniChem at EBI.