Dataset

Norverapamil; LC-ESI-Q; MS; POS; 90 V

This MassBank record with Accession MSBNK-Waters-WA002913 contains the MS mass spectrum of Norverapamil with the InChIkey UPKQNCPKPOLASS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C26H36N2O4/c1-19(2)26(18-27,21-9-11-23(30-4)25(17-21)32-6)13-7-14-28-15-12-20-8-10-22(29-3)24(16-20)31-5/h8-11,16-17,19,28H,7,12-15H2,1-6H3
SMILES C(C(C(C)C)(c(c2)cc(c(OC)c2)OC)C#N)CCNCCc(c1)cc(OC)c(OC)c1
InChI Key UPKQNCPKPOLASS-UHFFFAOYSA-N
Molecular Formula C26H36N2O4
Exact Mass 440.268 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-WA002913
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propan-2-ylpentanenitrile
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    14881465 PubChem: Thomson Pharma
    67018-85-3 ACToR
    PD053668 ProbesDrugs
    DTXSID80873799 EPA CompTox Dashboard
    HMDB0060540 Human Metabolome Database
    SCHEMBL222066 SureChEMBL
    104972 PubChem
    CHEMBL1298 ChEMBL
    957Z3K3R56 FDA SRS
    HY-135328 MedChemExpress
    J264.593I Nikkaji
    134080 ChEBI
    50121977 BindingDB
    The data in this table is sourced from UniChem at EBI.