Dataset

Fluxapyroxad (BAS 700 F)-TP CSAA798670

This MassBank record with Accession MSBNK-Eawag-EQ418451 contains the MS2 mass spectrum of Fluxapyroxad (BAS 700 F)-TP CSAA798670 with the InChIkey RLOHOBNEYHBZID-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)
SMILES CN1C=C(C(O)=O)C(=N1)C(F)F
InChI Key RLOHOBNEYHBZID-UHFFFAOYSA-N
Molecular Formula C6H6F2N2O2
Exact Mass 176.040 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-EQ418451
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:44:51.903973
MetadataModified 2025-02-09T09:54:02.456900
MetadataPublished 2019-12-03
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
18983008 PubChem
MCULE-9147144469 Mcule
20527OAN56 FDA SRS
DTXSID80597105 EPA CompTox Dashboard
ZINC000040435261 ZINC
J2.629.165H Nikkaji
CB52474530 ChemicalBook
SCHEMBL20141 SureChEMBL
46499216 PubChem: Thomson Pharma
28220137 eMolecules
The data in this table is sourced from UniChem at EBI.