Dataset

Imidaclothiz; LC-ESI-QFT; MS2; CE: 120%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01127307 contains the MS2 mass spectrum of Imidaclothiz with the InChIkey OWRSHPAYDYCHSJ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C7H8ClN5O2S/c8-6-10-3-5(16-6)4-12-2-1-9-7(12)11-13(14)15/h3H,1-2,4H2,(H,9,11)
SMILES C1CN(C(=N1)N[N+](=O)[O-])CC2=CN=C(S2)Cl
InChI Key OWRSHPAYDYCHSJ-UHFFFAOYSA-N
Molecular Formula C7H8ClN5O2S
Exact Mass 261.009 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01127307
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MetadataPublished 2023-04-27
Related Molecule
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    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    137317042 PubChem
    135532694 PubChem
    SCHEMBL20591245 SureChEMBL
    136355710 PubChem
    DTXSID4057926 EPA CompTox Dashboard
    50487979 BindingDB
    CHEMBL2251730 ChEMBL
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    SCHEMBL238122 SureChEMBL
    105843-36-5 ACToR
    E070T0J4TU FDA SRS
    The data in this table is sourced from UniChem at EBI.