Dataset

Prazosin; LC-ESI-QFT; MS2; CE: 180%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01163509 contains the MS2 mass spectrum of Prazosin with the InChIkey IENZQIKPVFGBNW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)
SMILES COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC=CO4)N)OC
InChI Key IENZQIKPVFGBNW-UHFFFAOYSA-N
Molecular Formula C19H21N5O4
Exact Mass 383.159 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-Eawag-EQ01163509
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MetadataPublished 2024-01-16
Related Molecule
  • [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00457 drugbank
    CHEBI:8364 chebi
    XRA rcsb_pdb
    CHEMBL2 chembl
    26524 surechembl
    29376126 surechembl
    4893 pubchem
    XM03YJ541D fdasrs
    XRA - Ideal conformer pdbe
    503 gtopdb
    5385 gtopdb
    PD010017 probes_and_drugs
    WAHJAR CCDC
    145065 brenda
    145979 brenda
    167772 brenda
    229810 brenda
    229811 brenda
    HMDB0014600 hmdb
    Molport-000-891-036 molport
    4209 drugcentral
    29568 bindingdb
    The data in this table is sourced from UniChem at EBI.