Dataset

Chromafenozide; LC-ESI-QFT; MS2; CE: 90%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01121706 contains the MS2 mass spectrum of Chromafenozide with the InChIkey HPNSNYBUADCFDR-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)
SMILES CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C3=C(C=C2)OCCC3)C)C
InChI Key HPNSNYBUADCFDR-UHFFFAOYSA-N
Molecular Formula C24H30N2O3
Exact Mass 394.226 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-EQ01121706
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MetadataPublished 2023-04-27
Related Molecule
  • N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:38450 chebi
    CHEMBL227020 chembl
    73335 surechembl
    10157484 pubchem
    2ODM465D5M fdasrs
    PD101200 probes_and_drugs
    HMDB0250201 hmdb
    Molport-039-139-607 molport
    50488460 bindingdb
    The data in this table is sourced from UniChem at EBI.