Dataset

Dimethenamid-OXA

This MassBank record with Accession MSBNK-Athens_Univ-AU204004 contains the MS2 mass spectrum of Dimethenamid-OXA with the InChIkey HOYCASTVMCEOTP-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H17NO4S/c1-7-6-18-9(3)10(7)13(8(2)5-17-4)11(14)12(15)16/h6,8H,5H2,1-4H3,(H,15,16)
SMILES COCC(C)N(C(=O)C(O)=O)c1c(C)csc1C
InChI Key HOYCASTVMCEOTP-UHFFFAOYSA-N
Molecular Formula C12H17NO4S
Exact Mass 271.088 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-AU204004
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:46:01.947018
MetadataModified 2024-01-11T09:46:02.084253
MetadataPublished 2015-12-04
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MTBLC83460 Metabolights
DTXSID4037530 EPA CompTox Dashboard
83460 ChEBI
86290064 PubChem
J1.704.092H Nikkaji
The data in this table is sourced from UniChem at EBI.