Dataset

Asulam; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EA015611 contains the MS2 mass spectrum of Asulam with the InChIkey VGPYEHKOIGNJKV-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H10N2O4S/c1-14-8(11)10-15(12,13)7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11)
SMILES c1(S(NC(OC)=O)(=O)=O)ccc(N)cc1
InChI Key VGPYEHKOIGNJKV-UHFFFAOYSA-N
Molecular Formula C8H10N2O4S
Exact Mass 230.036 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-Eawag-EA015611
Version
Author
Maintainer
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MetadataPublished 2014-01-14
Related Molecule
  • methyl N-(4-aminophenyl)sulfonylcarbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:81696 chebi
    CHEMBL2137678 chembl
    64856 surechembl
    18752 pubchem
    0Y5ASM7P5S fdasrs
    PD198322 probes_and_drugs
    BILSEU CCDC
    147033 brenda
    HMDB0248680 hmdb
    The data in this table is sourced from UniChem at EBI.