Dataset

Methoxyfenozide

This MassBank record with Accession MSBNK-Waters-WA000164 contains the MS2 mass spectrum of Methoxyfenozide with the InChIkey QCAWEPFNJXQPAN-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C22H28N2O3/c1-14-11-15(2)13-17(12-14)21(26)24(22(4,5)6)23-20(25)18-9-8-10-19(27-7)16(18)3/h8-13H,1-7H3,(H,23,25)
SMILES	COc(c2)c(C)c(cc2)C(=O)NN(C(C)(C)C)C(=O)c(c1)cc(C)cc(C)1
InChI Key	QCAWEPFNJXQPAN-UHFFFAOYSA-N
Molecular Formula	C22H28N2O3
Exact Mass	368.210 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000164
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:49:32.525749
MetadataModified	2024-01-11T22:49:32.719358
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
50128305	BindingDB
HMDB0254547	Human Metabolome Database
J981.614C	Nikkaji
MolPort-008-266-409	MolPort
SCHEMBL27595	SureChEMBL
HY-117386	MedChemExpress
DTXSID3032628	EPA CompTox Dashboard
ZINC000002511852	ZINC
CHEMBL55772	ChEMBL
C18525	KEGG Ligand
38449	ChEBI
30424549	eMolecules
14803883	PubChem: Thomson Pharma
163442-56-6	ACToR
62A22651ZX	FDA SRS
161050-58-4	ACToR
PD119556	ProbesDrugs
105010	PubChem
CB6249429	ChemicalBook
The data in this table is sourced from UniChem at EBI.