Dataset

Rinderine; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR310570 contains the MS2 mass spectrum of Rinderine with the InChIkey SFVVQRJOGUKCEG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3
SMILES CC(C)C(O)(C(C)O)C(=O)OCC1=CCN2CCC(O)C12
InChI Key SFVVQRJOGUKCEG-UHFFFAOYSA-N
Molecular Formula C15H25NO5
Exact Mass 299.367 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-PR310570
Version
Author
Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • (7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:182293 chebi
    16058911 surechembl
    22384 pubchem
    PD093743 probes_and_drugs
    HMDB0253457 hmdb
    DTXSID60864145 comptox
    82409 bindingdb
    86682 bindingdb
    The data in this table is sourced from UniChem at EBI.