Dataset

(1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol; LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00350 contains the MS2 mass spectrum of (1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol with the InChIkey FRSRMZNTUGSNRW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H27NO5/c1-23-7-6-13-15(11-24)21(27-4)22(28-5)20-14-10-18(26-3)17(25-2)9-12(14)8-16(23)19(13)20/h9-10,16,24H,6-8,11H2,1-5H3
SMILES CN1CCC2=C(C(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC)OC)OC)CO
InChI Key FRSRMZNTUGSNRW-UHFFFAOYSA-N
Molecular Formula C22H27NO5
Exact Mass 385.189 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-Washington_State_Univ-BML00350
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Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • (1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-3-yl)methanol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-2819063450 Mcule
    CHEMBL1560835 ChEMBL
    SCHEMBL14029313 SureChEMBL
    3774499 PubChem
    8314125 eMolecules
    181461 ChEBI
    The data in this table is sourced from UniChem at EBI.