Dataset

Ammodendrine; LC-APCI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80727 contains the MS mass spectrum of Ammodendrine with the InChIkey APKLQIQRPUDADG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H20N2O/c1-10(15)14-8-4-5-11(9-14)12-6-2-3-7-13-12/h9,12-13H,2-8H2,1H3
SMILES CC(=O)N1CCCC(=C1)C2CCCCN2
InChI Key APKLQIQRPUDADG-UHFFFAOYSA-N
Molecular Formula C12H20N2O
Exact Mass 208.158 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-Washington_State_Univ-BML80727
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 1-(5-piperidin-2-yl-3,4-dihydro-2H-pyridin-1-yl)ethanone
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL1755290 SureChEMBL
    15244558 PubChem: Thomson Pharma
    60068190 NMRShiftDB
    J122.265A Nikkaji
    108191 PubChem
    The data in this table is sourced from UniChem at EBI.