Dataset

Isocarbophos

This MassBank record with Accession MSBNK-Eawag-EQ01137504 contains the MS2 mass spectrum of Isocarbophos with the InChIkey YFVOXLJXJBQDEF-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H16NO4PS/c1-8(2)15-11(13)9-6-4-5-7-10(9)16-17(12,18)14-3/h4-8H,1-3H3,(H2,12,18)
SMILES CC(C)OC(=O)C1=CC=CC=C1OP(=S)(N)OC
InChI Key YFVOXLJXJBQDEF-UHFFFAOYSA-N
Molecular Formula C11H16NO4PS
Exact Mass 289.054 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-EQ01137504
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:24:27.551589
MetadataModified 2025-02-09T09:55:07.586330
MetadataPublished 2023-04-27
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
38704 ChEBI
DTXSID7042063 EPA CompTox Dashboard
CHEMBL3185588 ChEMBL
7741NPW06X FDA SRS
J1.786.837C Nikkaji
90479 PubChem
SCHEMBL117792 SureChEMBL
24353-61-5 ACToR
499055 eMolecules
The data in this table is sourced from UniChem at EBI.