Dataset

Morantel

This MassBank record with Accession MSBNK-Athens_Univ-AU113805 contains the MS2 mass spectrum of Morantel with the InChIkey NVEPPWDVLBMNMB-SNAWJCMRSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H16N2S/c1-10-6-9-15-11(10)4-5-12-13-7-3-8-14(12)2/h4-6,9H,3,7-8H2,1-2H3/b5-4+
SMILES Cc1ccsc1/C=C/C2=NCCCN2C
InChI Key NVEPPWDVLBMNMB-SNAWJCMRSA-N
Molecular Formula C12H16N2S
Exact Mass 220.103 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-Athens_Univ-AU113805
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:41:29.535759
MetadataModified 2024-01-11T09:41:29.679342
MetadataPublished 2015-09-23
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL123923 SureChEMBL
PD013252 ProbesDrugs
5353792 PubChem
7NJ031HAX5 FDA SRS
14773566 PubChem: Thomson Pharma
20574-50-9 ACToR
CHEMBL1240978 ChEMBL
J4.425C Nikkaji
J58.054F Nikkaji
MORANTEL TARTRATE rxnorm
62879 BindingDB
MORANTEL rxnorm
DTXSID9048562 EPA CompTox Dashboard
ZINC000000001750 ZINC
The data in this table is sourced from UniChem at EBI.