Dataset

Rebemide; LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV

This MassBank record with Accession MSBNK-Fiocruz-FIO00397 contains the MS2 mass spectrum of Rebemide with the InChIkey JLNGEXDJAQASHD-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H15NO/c1-3-12(4-2)11(13)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
SMILES CCN(CC)C(=O)c(c1)cccc1
InChI Key JLNGEXDJAQASHD-UHFFFAOYSA-N
Molecular Formula C11H15NO
Exact Mass 177.115 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-Fiocruz-FIO00397
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MetadataPublished 2016-01-19
Related Molecule
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    Measurement Technique liquid chromatography-mass spectrometry
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    Data-Source Molecule ID Data-Source
    180965 ChEBI
    15542 PubChem
    1696-17-9 ACToR
    3Y74433ZXI FDA SRS
    14818504 PubChem: Thomson Pharma
    889469 eMolecules
    MCULE-8846038964 Mcule
    SCHEMBL72112 SureChEMBL
    20026481 NMRShiftDB
    J7.563I Nikkaji
    ZINC000000394108 ZINC
    DTXSID0051784 EPA CompTox Dashboard
    CB6237033 ChemicalBook
    The data in this table is sourced from UniChem at EBI.