Dataset

8-Geranyloxy psoralen; LC-APCI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80642 contains the MS mass spectrum of 8-Geranyloxy psoralen with the InChIkey SOVNCTNQAWWYAQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H22O4/c1-14(2)5-4-6-15(3)9-11-24-21-19-17(10-12-23-19)13-16-7-8-18(22)25-20(16)21/h5,7-10,12-13H,4,6,11H2,1-3H3
SMILES CC(=CCCC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C)C
InChI Key SOVNCTNQAWWYAQ-UHFFFAOYSA-N
Molecular Formula C21H22O4
Exact Mass 338.152 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-BML80642
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Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 9-(3,7-dimethylocta-2,6-dienoxy)furo[3,2-g]chromen-7-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-5870863701 Mcule
    155658 PubChem
    PD130352 ProbesDrugs
    The data in this table is sourced from UniChem at EBI.