Dataset

Etymemazine (oxide)

This MassBank record with Accession MSBNK-Waters-WA002243 contains the MS mass spectrum of Etymemazine (oxide) with the InChIkey USKHCLAXJXCWMO-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C20H26N2S/c1-5-16-10-11-20-18(12-16)22(14-15(2)13-21(3)4)17-8-6-7-9-19(17)23-20/h6-12,15H,5,13-14H2,1-4H3
SMILES CN(C)CC(C)CN(c21)c(c3)c(ccc(CC)3)Sc(cccc2)1
InChI Key USKHCLAXJXCWMO-UHFFFAOYSA-N
Molecular Formula C20H26N2S
Exact Mass 326.182 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002243
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:37:07.094211
MetadataModified 2025-02-09T20:22:15.330192
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
71823 PubChem
SCHEMBL790986 SureChEMBL
31592743 eMolecules
PD014678 ProbesDrugs
15074659 PubChem: Thomson Pharma
523-54-6 ACToR
CHEMBL2008544 ChEMBL
J6.633H Nikkaji
3742 DrugCentral
DTXSID0046935 EPA CompTox Dashboard
861J4K81C7 FDA SRS
DB11517 DrugBank
CB01178687 ChemicalBook
135393 ChEBI
The data in this table is sourced from UniChem at EBI.