Dataset

Bifenazate

This MassBank record with Accession MSBNK-Eawag-EQ00350607 contains the MS2 mass spectrum of Bifenazate with the InChIkey VHLKTXFWDRXILV-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H20N2O3/c1-12(2)22-17(20)19-18-15-11-14(9-10-16(15)21-3)13-7-5-4-6-8-13/h4-12,18H,1-3H3,(H,19,20)
SMILES CC(C)OC(=O)NNC1=C(C=CC(=C1)C2=CC=CC=C2)OC
InChI Key VHLKTXFWDRXILV-UHFFFAOYSA-N
Molecular Formula C17H20N2O3
Exact Mass 300.147 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-EQ00350607
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T10:34:22.682863
MetadataModified 2025-02-09T10:34:22.843408
MetadataPublished 2024-06-14
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CB4474290 ChemicalBook
176879 PubChem
SCHEMBL26414 SureChEMBL
14873782 PubChem: Thomson Pharma
24Z9QW0505 FDA SRS
149877-41-8 ACToR
PD076436 ProbesDrugs
J1.366.825F Nikkaji
HY-119687 MedChemExpress
DTXSID5032525 EPA CompTox Dashboard
ZINC000002511856 ZINC
CHEMBL1872845 ChEMBL
38660 ChEBI
C18589 KEGG Ligand
The data in this table is sourced from UniChem at EBI.