Dataset

Imidaclothiz

This MassBank record with Accession MSBNK-Eawag-EQ01127302 contains the MS2 mass spectrum of Imidaclothiz with the InChIkey OWRSHPAYDYCHSJ-UHFFFAOYSA-N.

Chemical Info

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-EQ01127302
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:20:28.604208
MetadataModified 2025-02-09T09:55:27.448753
MetadataPublished 2023-04-27
Field Value
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
184601 PubChem
15221563 PubChem: Thomson Pharma
SCHEMBL238122 SureChEMBL
105843-36-5 ACToR
E070T0J4TU FDA SRS
The data in this table is sourced from UniChem at EBI.