Dataset

10,11-Dihydrocarbamazepine; LC-ESI-QTOF; MS2; 110 V

This MassBank record with Accession MSBNK-BAFG-CSL2311094721 contains the MS2 mass spectrum of 10,11-Dihydrocarbamazepine with the InChIkey PHNLCHMJDSSPDQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H14N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-8H,9-10H2,(H2,16,18)
SMILES NC(=O)N1c2ccccc2CCc3ccccc13
InChI Key PHNLCHMJDSSPDQ-UHFFFAOYSA-N
Molecular Formula C15H14N2O
Exact Mass 238.111 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311094721
Version
Author
Maintainer
Language
MetadataPublished 2023-11-09
Related Molecule
  • 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DTXSID90189151 EPA CompTox Dashboard
    J13.566F Nikkaji
    50446087 BindingDB
    VACTAU CCDC
    HMDB0244276 Human Metabolome Database
    ZINC000003008650 ZINC
    CB7188846 ChemicalBook
    19099 PubChem
    14773973 PubChem: Thomson Pharma
    3564-73-6 ACToR
    CHEMBL41543 ChEMBL
    PD055415 ProbesDrugs
    487366 eMolecules
    EC017VA9FR FDA SRS
    SCHEMBL1744688 SureChEMBL
    MCULE-5197094540 Mcule
    The data in this table is sourced from UniChem at EBI.