Dataset

Ethopropazine (oxide)

This MassBank record with Accession MSBNK-Waters-WA002111 contains the MS mass spectrum of Ethopropazine (oxide) with the InChIkey CDOZDBSBBXSXLB-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C19H24N2S/c1-4-20(5-2)15(3)14-21-16-10-6-8-12-18(16)22-19-13-9-7-11-17(19)21/h6-13,15H,4-5,14H2,1-3H3
SMILES	CCN(CC)C(C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1
InChI Key	CDOZDBSBBXSXLB-UHFFFAOYSA-N
Molecular Formula	C19H24N2S
Exact Mass	312.166 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-WA002111
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:30:23.112012
MetadataModified	2025-02-09T20:25:46.196412
MetadataPublished	2016-01-19
Related Molecule

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEMBL1206	ChEMBL
DB00392	DrugBank
313639	ChEBI
7181	Guide to Pharmacology
J2.060E	Nikkaji
8958	BindingDB
ETHOPROPAZINE HYDROCHLORIDE	rxnorm
PROFENAMINE	rxnorm
7WI4P02YN1	FDA SRS
MCULE-1873220615	Mcule
DTXSID2023018	EPA CompTox Dashboard
1086	DrugCentral
47224	Brenda
PD010074	ProbesDrugs
SCHEMBL34045	SureChEMBL
LSM-1342	LINCS
522-00-9	ACToR
PA449531	PharmGKB
14923459	PubChem: Thomson Pharma
3290	PubChem
1986772	eMolecules
2999	Brenda
HMDB0014536	Human Metabolome Database
The data in this table is sourced from UniChem at EBI.