Dataset

Etymemazine (oxide); LC-ESI-Q; MS; POS; 45 V

This MassBank record with Accession MSBNK-Waters-WA002244 contains the MS mass spectrum of Etymemazine (oxide) with the InChIkey USKHCLAXJXCWMO-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H26N2S/c1-5-16-10-11-20-18(12-16)22(14-15(2)13-21(3)4)17-8-6-7-9-19(17)23-20/h6-12,15H,5,13-14H2,1-4H3
SMILES CN(C)CC(C)CN(c21)c(c3)c(ccc(CC)3)Sc(cccc2)1
InChI Key USKHCLAXJXCWMO-UHFFFAOYSA-N
Molecular Formula C20H26N2S
Exact Mass 326.182 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-WA002244
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MetadataPublished 2016-01-19
Related Molecule
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    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    71823 PubChem
    SCHEMBL790986 SureChEMBL
    31592743 eMolecules
    PD014678 ProbesDrugs
    15074659 PubChem: Thomson Pharma
    523-54-6 ACToR
    CHEMBL2008544 ChEMBL
    J6.633H Nikkaji
    3742 DrugCentral
    DTXSID0046935 EPA CompTox Dashboard
    861J4K81C7 FDA SRS
    DB11517 DrugBank
    CB01178687 ChemicalBook
    135393 ChEBI
    The data in this table is sourced from UniChem at EBI.