Dataset

Amlodipine

This MassBank record with Accession MSBNK-Waters-WA001848 contains the MS mass spectrum of Amlodipine with the InChIkey HTIQEAQVCYTUBX-KRWDZBQOSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C20H25ClN2O5/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21/h5-8,17,23H,4,9-11,22H2,1-3H3/t17-/m0/s1
SMILES NCCOCC(N1)=C(C(=O)OCC)C(c(c2)c(Cl)ccc2)C(C(=O)OC)=C(C)1
InChI Key HTIQEAQVCYTUBX-KRWDZBQOSA-N
Molecular Formula C20H25ClN2O5
Exact Mass 408.145 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-WA001848
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:43:44.613435
MetadataModified 2025-02-09T20:27:31.148158
MetadataPublished 2016-01-19
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL41283 SureChEMBL
CB2511519 ChemicalBook
ZINC000100001964 ZINC
27516200 eMolecules
14806267 PubChem: Thomson Pharma
14781769 PubChem: Thomson Pharma
9822750 PubChem
PD008989 ProbesDrugs
LEVAMLODIPINE MALEATE clinicaltrials
0P6NLP6806 FDA SRS
CHEMBL2111097 ChEMBL
LEVAMLODIPINE rxnorm
LEVAMLODIPINE DailyMed
4099 DrugCentral
6UB PDBe
DB09237 DrugBank
HY-14744 MedChemExpress
LEVAMLODIPINE clinicaltrials
J512.131K Nikkaji
53796 ChEBI
The data in this table is sourced from UniChem at EBI.