Dataset

Tolterodine; LC-ESI-QFT; MS2; CE: 30%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01108702 contains the MS2 mass spectrum of Tolterodine with the InChIkey OOGJQPCLVADCPB-HXUWFJFHSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H31NO/c1-16(2)23(17(3)4)14-13-20(19-9-7-6-8-10-19)21-15-18(5)11-12-22(21)24/h6-12,15-17,20,24H,13-14H2,1-5H3/t20-/m1/s1
SMILES CC(C)N(CC[C@H](C1=CC=CC=C1)C1=C(O)C=CC(C)=C1)C(C)C
InChI Key OOGJQPCLVADCPB-HXUWFJFHSA-N
Molecular Formula C22H31NO
Exact Mass 325.241 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-EQ01108702
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MetadataPublished 2024-06-14
Related Molecule
  • 2-[(1R)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB01036 drugbank
    CHEBI:9622 chebi
    CHEMBL1382 chembl
    29379290 surechembl
    3064 surechembl
    443879 pubchem
    WHE7A56U7K fdasrs
    PD009584 probes_and_drugs
    169000 brenda
    HMDB0015170 hmdb
    Molport-002-885-868 molport
    2705 drugcentral
    50165008 bindingdb
    The data in this table is sourced from UniChem at EBI.