Dataset

Methiocarb-TP methiocarb sulfone phenol (M05)

This MassBank record with Accession MSBNK-Eawag-EQ420452 contains the MS2 mass spectrum of Methiocarb-TP methiocarb sulfone phenol (M05) with the InChIkey GRBGKIGVRUXTSK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H12O3S/c1-6-4-8(10)5-7(2)9(6)13(3,11)12/h4-5,10H,1-3H3
SMILES CC1=CC(O)=CC(C)=C1S(C)(=O)=O
InChI Key GRBGKIGVRUXTSK-UHFFFAOYSA-N
Molecular Formula C9H12O3S
Exact Mass 200.051 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-EQ420452
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T13:28:55.967921
MetadataModified 2025-02-09T10:34:02.659462
MetadataPublished 2019-12-03
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
203615 PubChem
SCHEMBL13548324 SureChEMBL
14763-62-3 ACToR
DTXSID4041496 EPA CompTox Dashboard
J3.251.835D Nikkaji
G92SF33LLA FDA SRS
The data in this table is sourced from UniChem at EBI.