Dataset

Amphetamine; LC-ESI-Q; MS; POS; 45 V

This MassBank record with Accession MSBNK-Waters-WA000409 contains the MS mass spectrum of Amphetamine with the InChIkey KWTSXDURSIMDCE-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
SMILES CC(N)Cc(c1)cccc1
InChI Key KWTSXDURSIMDCE-UHFFFAOYSA-N
Molecular Formula C9H13N
Exact Mass 135.105 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000409
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
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    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00182 drugbank
    CHEBI:132233 chebi
    CHEMBL405 chembl
    8858 surechembl
    3007 pubchem
    CK833KGX7E fdasrs
    2146 gtopdb
    2147 gtopdb
    4804 gtopdb
    PD010185 probes_and_drugs
    23090 brenda
    259092 brenda
    39740 brenda
    5131 brenda
    HMDB0014328 hmdb
    50042798 bindingdb
    50042804 bindingdb
    50089783 bindingdb
    50089789 bindingdb
    50099021 bindingdb
    50099029 bindingdb
    50162745 bindingdb
    50162784 bindingdb
    50206482 bindingdb
    50612185 bindingdb
    50612211 bindingdb
    50616397 bindingdb
    50616420 bindingdb
    50666300 bindingdb
    50731741 bindingdb
    50743732 bindingdb
    50757563 bindingdb
    50762857 bindingdb
    50830074 bindingdb
    50879623 bindingdb
    50987303 bindingdb
    51180463 bindingdb
    195 drugcentral
    The data in this table is sourced from UniChem at EBI.