Dataset

Homatropine; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR301747 contains the MS2 mass spectrum of Homatropine with the InChIkey ZTVIKZXZYLEVOL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H21NO3/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11/h2-6,12-15,18H,7-10H2,1H3
SMILES CN1C2CCC1CC(C2)OC(=O)C(O)C1=CC=CC=C1
InChI Key ZTVIKZXZYLEVOL-UHFFFAOYSA-N
Molecular Formula C16H21NO3
Exact Mass 275.348 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301747
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Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J390.985I Nikkaji
    HMDB0253199 Human Metabolome Database
    MCULE-7109134658 Mcule
    82370 BindingDB
    CHEMBL1237117 ChEMBL
    SCHEMBL23970 SureChEMBL
    100703 Brenda
    3623 PubChem
    PD068765 ProbesDrugs
    969228 eMolecules
    The data in this table is sourced from UniChem at EBI.