Dataset

L-Tyrosine; LC-ESI-ITFT; MS2; m/z:611.14; NEG

This MassBank record with Accession MSBNK-NAIST-KNA00575 contains the MS2 mass spectrum of L-Tyrosine with the InChIkey OUYCCCASQSFEME-QMMMGPOBSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
SMILES OC(=O)C(N)Cc(c1)ccc(O)c1
InChI Key OUYCCCASQSFEME-QMMMGPOBSA-N
Molecular Formula C9H11NO3
Exact Mass 181.074 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-NAIST-KNA00575
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MetadataPublished 2016-01-19
Related Molecule
  • (2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00135 drugbank
    CHEBI:17895 chebi
    CHEBI:58315 chebi
    TYR rcsb_pdb
    CHEMBL925 chembl
    1581 surechembl
    6057 pubchem
    6942100 pubchem
    42HK56048U fdasrs
    PD007194 probes_and_drugs
    LTYROS CCDC
    109 brenda
    185000 brenda
    20761 brenda
    229017 brenda
    233214 brenda
    30315 brenda
    415 brenda
    45800 brenda
    47528 brenda
    618 brenda
    709 brenda
    TYR - Ideal conformer pdbe
    HMDB0000158 hmdb
    2786 drugcentral
    18129 bindingdb
    The data in this table is sourced from UniChem at EBI.