Dataset

Phosphinothricin; LC-ESI-Q; MS; POS; 60 V, 75 V

This MassBank record with Accession MSBNK-Waters-WA002709 contains the MS mass spectrum of Phosphinothricin with the InChIkey IAJOBQBIJHVGMQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C5H12NO4P/c1-11(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)
SMILES NC(CCP(C)(O)=O)C(O)=O
InChI Key IAJOBQBIJHVGMQ-UHFFFAOYSA-N
Molecular Formula C5H12NO4P
Exact Mass 181.050 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-WA002709
Version
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:142851 chebi
    CHEMBL450298 chembl
    14826101 surechembl
    17697 surechembl
    4794 pubchem
    5257279 pubchem
    5257280 pubchem
    PD093524 probes_and_drugs
    71999 brenda
    C8W4FP6BTY fdasrs
    HMDB0252799 hmdb
    DTXSID0043973 comptox
    The data in this table is sourced from UniChem at EBI.