Dataset

Ethylmorphine; LC-ESI-Q; MS; POS; 75 V

This MassBank record with Accession MSBNK-Waters-WA002941 contains the MS mass spectrum of Ethylmorphine with the InChIkey OGDVEMNWJVYAJL-LEPYJNQMSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C19H23NO3/c1-3-22-15-7-4-11-10-13-12-5-6-14(21)18-19(12,8-9-20(13)2)16(11)17(15)23-18/h4-7,12-14,18,21H,3,8-10H2,1-2H3/t12-,13+,14-,18-,19-/m0/s1
SMILES CCOc(c5)c(O4)c(c(c5)1)C(C2)(C34)C([H])(C=CC(O)3)C(N(C)C2)C1
InChI Key OGDVEMNWJVYAJL-LEPYJNQMSA-N
Molecular Formula C19H23NO3
Exact Mass 313.168 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002941
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • (4R,4aR,7S,7aR,12bS)-9-ethoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB01466 drugbank
    CHEBI:4902 chebi
    CHEMBL1712170 chembl
    24971 surechembl
    29392212 surechembl
    5359271 pubchem
    RWO67D87EU fdasrs
    PD009487 probes_and_drugs
    OPOQER CCDC
    20266 brenda
    HMDB0015509 hmdb
    DTXSID1046760 comptox
    3207 drugcentral
    The data in this table is sourced from UniChem at EBI.