Dataset

Modafinil; LC-ESI-Q; MS; POS; 30 V

This MassBank record with Accession MSBNK-Waters-WA002960 contains the MS mass spectrum of Modafinil with the InChIkey YFGHCGITMMYXAQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H15NO2S/c16-14(17)11-19(18)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17)
SMILES NC(=O)CS(=O)C(c(c2)cccc2)c(c1)cccc1
InChI Key YFGHCGITMMYXAQ-UHFFFAOYSA-N
Molecular Formula C15H15NO2S
Exact Mass 273.082 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-WA002960
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
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    CHEMBL1373 chembl
    34488 surechembl
    4236 pubchem
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    PD000912 probes_and_drugs
    ETEXIK CCDC
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    The data in this table is sourced from UniChem at EBI.