Dataset

Thiacloprid

This MassBank record with Accession MSBNK-Athens_Univ-AU302403 contains the MS2 mass spectrum of Thiacloprid with the InChIkey HOKKPVIRMVDYPB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2
SMILES C1CSC(=NC#N)N1CC2=CN=C(C=C2)Cl
InChI Key HOKKPVIRMVDYPB-UHFFFAOYSA-N
Molecular Formula C10H9ClN4S
Exact Mass 252.024 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-Athens_Univ-AU302403
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:45:54.066935
MetadataModified 2024-01-11T09:45:54.213512
MetadataPublished 2015-12-08
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
HMDB0258967 Human Metabolome Database
39175 ChEBI
ZINC000255976955 ZINC
32176311 eMolecules
SCHEMBL26491 SureChEMBL
115224 PubChem
PD036072 ProbesDrugs
The data in this table is sourced from UniChem at EBI.