Dataset

Physostigmine; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR310559 contains the MS2 mass spectrum of Physostigmine with the InChIkey PIJVFDBKTWXHHD-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)
SMILES CNC(=O)OC1=CC=C2N(C)C3N(C)CCC3(C)C2=C1
InChI Key PIJVFDBKTWXHHD-UHFFFAOYSA-N
Molecular Formula C15H21N3O2
Exact Mass 275.352 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-PR310559
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Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • (3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl) N-methylcarbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    20054745 NMRShiftDB
    4811 PubChem
    PD071427 ProbesDrugs
    16182158 PubChem: Thomson Pharma
    57-47-6 ACToR
    SCHEMBL24045 SureChEMBL
    182905 ChEBI
    1971450 eMolecules
    CHEMBL11773 ChEMBL
    MCULE-3610265172 Mcule
    10709 BindingDB
    J2.708.708F Nikkaji
    The data in this table is sourced from UniChem at EBI.