Dataset

Vigabatrin; LC-ESI-Q; MS; POS; 15 V

This MassBank record with Accession MSBNK-Waters-WA000442 contains the MS mass spectrum of Vigabatrin with the InChIkey PJDFLNIOAUIZSL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H11NO2/c1-2-5(7)3-4-6(8)9/h2,5H,1,3-4,7H2,(H,8,9)
SMILES C=CC(N)CCC(O)=O
InChI Key PJDFLNIOAUIZSL-UHFFFAOYSA-N
Molecular Formula C6H11NO2
Exact Mass 129.079 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-WA000442
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
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    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
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    CHEMBL89598 chembl
    26714 surechembl
    25202592 pubchem
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    GR120KRT6K fdasrs
    4821 gtopdb
    PD002625 probes_and_drugs
    213168 brenda
    23509 brenda
    3140 brenda
    91632 brenda
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    HMDB0015212 hmdb
    DTXSID4041153 comptox
    NCT00373581 clinicaltrials
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    NCT00611130 clinicaltrials
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    Molport-003-666-796 molport
    2819 drugcentral
    50118886 bindingdb
    The data in this table is sourced from UniChem at EBI.