Dataset

Tuberostemonine; LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00866 contains the MS2 mass spectrum of Tuberostemonine with the InChIkey GYOGHROCTSEKDY-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H33NO4/c1-4-13-14-7-5-6-8-23-16(17-9-11(2)21(24)26-17)10-15(19(14)23)18-12(3)22(25)27-20(13)18/h11-20H,4-10H2,1-3H3
SMILES CCC1C2CCCCN3C2C(CC3C4CC(C(=O)O4)C)C5C1OC(=O)C5C
InChI Key GYOGHROCTSEKDY-UHFFFAOYSA-N
Molecular Formula C22H33NO4
Exact Mass 375.241 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-Washington_State_Univ-BML00866
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Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 10-ethyl-14-methyl-3-(4-methyl-5-oxooxolan-2-yl)-12-oxa-4-azatetracyclo[7.6.1.04,16.011,15]hexadecan-13-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    27973585 surechembl
    435242 pubchem
    PD086889 probes_and_drugs
    Molport-039-338-825 molport
    The data in this table is sourced from UniChem at EBI.