Dataset

O-Desmethyltramadol; LC-ESI-QTOF; MS2; CE: Ramp 19.8-29.7 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU226906 contains the MS2 mass spectrum of O-Desmethyltramadol with the InChIkey RSMYYINTIXFRCJ-JDLVMGNASA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H23NO2/c1-16(2)10-12-6-4-8-14(18)15(12)11-5-3-7-13(17)9-11/h3,5,7,9,12,14-15,17-18H,4,6,8,10H2,1-2H3/t12-,14?,15-/m0/s1
SMILES CN(C)C[C@@H]1CCCC([C@H]1C2=CC(=CC=C2)O)O
InChI Key RSMYYINTIXFRCJ-JDLVMGNASA-N
Molecular Formula C15H23NO2
Exact Mass 249.173 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU226906
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MetadataPublished 2018-12-19
Related Molecule
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    Measurement Technique liquid chromatography-mass spectrometry
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    Data-Source Molecule ID Data-Source
    91747931 PubChem
    The data in this table is sourced from UniChem at EBI.