Dataset

JWH-073; LC-ESI-QTOF; MS2; HILIC; CE: 50 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU170411 contains the MS2 mass spectrum of JWH-073 with the InChIkey VCHHHSMPMLNVGS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C23H21NO/c1-2-3-15-24-16-21(19-12-6-7-14-22(19)24)23(25)20-13-8-10-17-9-4-5-11-18(17)20/h4-14,16H,2-3,15H2,1H3
SMILES CCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43
InChI Key VCHHHSMPMLNVGS-UHFFFAOYSA-N
Molecular Formula C23H21NO
Exact Mass 327.162 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-AU170411
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MetadataPublished 2016-02-26
Related Molecule
  • (1-butylindol-3-yl)-naphthalen-1-ylmethanone
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:181123 chebi
    CHEMBL2380416 chembl
    11983320 surechembl
    29375790 surechembl
    10471670 pubchem
    BBX3BP2772 fdasrs
    PD016808 probes_and_drugs
    EROCIY CCDC
    HMDB0245597 hmdb
    85804 bindingdb
    The data in this table is sourced from UniChem at EBI.