Dataset

Piperine; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU252302 contains the MS2 mass spectrum of Piperine with the InChIkey MXXWOMGUGJBKIW-YPCIICBESA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+
SMILES O=C(\C=C\C=C\C1=CC2=C(OCO2)C=C1)N1CCCCC1
InChI Key MXXWOMGUGJBKIW-YPCIICBESA-N
Molecular Formula C17H19NO3
Exact Mass 285.136 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU252302
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MetadataPublished 2019-04-08
Related Molecule
  • (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB12582 drugbank
    CHEBI:28821 chebi
    AYR rcsb_pdb
    CHEMBL43185 chembl
    29358781 surechembl
    94058 surechembl
    638024 pubchem
    U71XL721QK fdasrs
    PD001540 probes_and_drugs
    PIPINE CCDC
    179890 brenda
    20806 brenda
    45695 brenda
    HMDB0029377 hmdb
    410499 bindingdb
    410502 bindingdb
    50158320 bindingdb
    50547680 bindingdb
    50547681 bindingdb
    50547682 bindingdb
    50929630 bindingdb
    50929650 bindingdb
    50952597 bindingdb
    50952598 bindingdb
    50980621 bindingdb
    50980631 bindingdb
    51015593 bindingdb
    51189385 bindingdb
    51209977 bindingdb
    51230055 bindingdb
    51292031 bindingdb
    51475726 bindingdb
    51475727 bindingdb
    51489951 bindingdb
    Molport-001-759-210 molport
    The data in this table is sourced from UniChem at EBI.