Dataset

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

This MassBank record with Accession MSBNK-Athens_Univ-AU271202 contains the MS2 mass spectrum of Terbinafine with the InChIkey DOMXUEMWDBAQBQ-WEVVVXLNSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H25N/c1-21(2,3)15-8-5-9-16-22(4)17-19-13-10-12-18-11-6-7-14-20(18)19/h5-7,9-14H,16-17H2,1-4H3/b9-5+
SMILES CN(C\C=C\C#CC(C)(C)C)CC1=CC=CC2=CC=CC=C12
InChI Key DOMXUEMWDBAQBQ-WEVVVXLNSA-N
Molecular Formula C21H25N
Exact Mass 291.199 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-AU271202
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MetadataPublished 2019-05-30
Related Molecule
  • (E)-N,6,6-trimethyl-N-(naphthalen-1-ylmethyl)hept-2-en-4-yn-1-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00857 drugbank
    CHEBI:9448 chebi
    CHEMBL822 chembl
    29353314 surechembl
    36794 surechembl
    1549008 pubchem
    G7RIW8S0XP fdasrs
    PD009684 probes_and_drugs
    165845 brenda
    3534 brenda
    HMDB0014995 hmdb
    Molport-002-507-761 molport
    2597 drugcentral
    50018518 bindingdb
    The data in this table is sourced from UniChem at EBI.