Dataset

Cyanophos

This MassBank record with Accession MSBNK-Eawag-EQ01134201 contains the MS2 mass spectrum of Cyanophos with the InChIkey SCKHCCSZFPSHGR-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H10NO3PS/c1-11-14(15,12-2)13-9-5-3-8(7-10)4-6-9/h3-6H,1-2H3
SMILES COP(=S)(OC)OC1=CC=C(C=C1)C#N
InChI Key SCKHCCSZFPSHGR-UHFFFAOYSA-N
Molecular Formula C9H10NO3PS
Exact Mass 243.012 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-EQ01134201
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:03:29.472086
MetadataModified 2025-02-09T09:55:28.681065
MetadataPublished 2023-04-27
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL2271089 ChEMBL
511146 eMolecules
16711231 PubChem: Thomson Pharma
17522 PubChem
2636-26-2 ACToR
SCHEMBL83422 SureChEMBL
2AB0Z99OXP FDA SRS
12692-90-9 ACToR
CB7452291 ChemicalBook
J3.394D Nikkaji
HMDB0250614 Human Metabolome Database
ZINC000002035982 ZINC
DTXSID0041806 EPA CompTox Dashboard
38621 ChEBI
C18397 KEGG Ligand
The data in this table is sourced from UniChem at EBI.