Dataset

Hydroxyzine; LC-ESI-Q; MS; POS; 60 V

This MassBank record with Accession MSBNK-Waters-WA002930 contains the MS mass spectrum of Hydroxyzine with the InChIkey ZQDWXGKKHFNSQK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H27ClN2O2/c22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-9,21,25H,10-17H2
SMILES OCCOCCN(C3)CCN(C3)C(c(c2)cccc2)c(c1)ccc(Cl)c1
InChI Key ZQDWXGKKHFNSQK-UHFFFAOYSA-N
Molecular Formula C21H27ClN2O2
Exact Mass 374.176 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-WA002930
Version
Author
Maintainer
Language
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
    DB00557 drugbank
    CHEBI:5818 chebi
    CHEMBL896 chembl
    4491 surechembl
    3658 pubchem
    30S50YM8OG fdasrs
    7199 gtopdb
    PD009966 probes_and_drugs
    145054 brenda
    145968 brenda
    146702 brenda
    HMDB0014697 hmdb
    182795 bindingdb
    182796 bindingdb
    41735 bindingdb
    50608119 bindingdb
    50753311 bindingdb
    51119277 bindingdb
    51119328 bindingdb
    51119350 bindingdb
    51119351 bindingdb
    868964 bindingdb
    Molport-002-506-318 molport
    1400 drugcentral
    The data in this table is sourced from UniChem at EBI.