Dataset

Amantadine

This MassBank record with Accession MSBNK-UFZ-UF414702 contains the MS2 mass spectrum of Amantadine with the InChIkey DKNWSYNQZKUICI-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2
SMILES NC12CC3CC(CC(C3)C1)C2
InChI Key DKNWSYNQZKUICI-UHFFFAOYSA-N
Molecular Formula C10H17N
Exact Mass 151.136 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF414702
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:48:55.364200
MetadataModified 2025-02-09T19:48:03.515014
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
AMANTADINE HYDROCHLORIDE rxnorm
GOCOVRI rxnorm
AMANTADINE rxnorm
GOCOVRI clinicaltrials
AMANTADINE clinicaltrials
AMANTADINE HYDROCHLORIDE clinicaltrials
SYMADINE clinicaltrials
SYMMETREL clinicaltrials
MANTADIX clinicaltrials
OSMOLEX clinicaltrials
BF4C9Z1J53 FDA SRS
DTXSID8022117 EPA CompTox Dashboard
MCULE-9686682307 Mcule
144 DrugCentral
ZINC000000968256 ZINC
4128 Guide to Pharmacology
DIGDOM CCDC
50033369 BindingDB
AMANTADINE DailyMed
10006057 NMRShiftDB
226548 Brenda
CHEMBL660 ChEMBL
C06818 KEGG Ligand
DB00915 DrugBank
2618 ChEBI
SCHEMBL4098 SureChEMBL
amantadine DailyMed
CB3259991 ChemicalBook
16839 Brenda
HMDB0015051 Human Metabolome Database
200826 Brenda
476391 eMolecules
27515804 eMolecules
2130 PubChem
PD009648 ProbesDrugs
LSM-3571 LINCS
15219251 PubChem: Thomson Pharma
PA448360 PharmGKB
768-94-5 ACToR
The data in this table is sourced from UniChem at EBI.