Dataset

Carbophenothion

This MassBank record with Accession MSBNK-Eawag-EQ01133301 contains the MS2 mass spectrum of Carbophenothion with the InChIkey VEDTXTNSFWUXGQ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H16ClO2PS3/c1-3-13-15(16,14-4-2)18-9-17-11-7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3
SMILES CCOP(=S)(OCC)SCSC1=CC=C(C=C1)Cl
InChI Key VEDTXTNSFWUXGQ-UHFFFAOYSA-N
Molecular Formula C11H16ClO2PS3
Exact Mass 341.974 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-EQ01133301
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T13:07:25.058202
MetadataModified 2025-02-09T10:34:18.958461
MetadataPublished 2023-04-27
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C18968 KEGG Ligand
CHEMBL452866 ChEMBL
DTXSID7022120 EPA CompTox Dashboard
J2.112A Nikkaji
ZINC000000001092 ZINC
82107 ChEBI
SCHEMBL10754 SureChEMBL
13081 PubChem
998NGA2Q61 FDA SRS
14952360 PubChem: Thomson Pharma
786-19-6 ACToR
PD014058 ProbesDrugs
509465 eMolecules
The data in this table is sourced from UniChem at EBI.