Dataset

Etymemazine (oxide)

This MassBank record with Accession MSBNK-Waters-WA002245 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-WA002245
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:49:18.755717
MetadataModified 2024-01-11T22:49:18.917326
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
71823 PubChem
J6.633H Nikkaji
DB11517 DrugBank
SCHEMBL790986 SureChEMBL
CB01178687 ChemicalBook
861J4K81C7 FDA SRS
31592743 eMolecules
PD014678 ProbesDrugs
15074659 PubChem: Thomson Pharma
523-54-6 ACToR
CHEMBL2008544 ChEMBL
3742 DrugCentral
DTXSID0046935 EPA CompTox Dashboard
135393 ChEBI
The data in this table is sourced from UniChem at EBI.