Dataset

(Ethoxycarbonylmethyl)triphenylphosphonium; LC-ESI-QTOF; MS2; 150 V

This MassBank record with Accession MSBNK-BAFG-CSL23111014955 contains the MS2 mass spectrum of (Ethoxycarbonylmethyl)triphenylphosphonium with the InChIkey BDBCCQWLFKVQRT-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C22H22O2P/c1-2-24-22(23)18-25(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17H,2,18H2,1H3/q+1
SMILES CCOC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI Key BDBCCQWLFKVQRT-UHFFFAOYSA-N
Molecular Formula [C22H22O2P]+
Exact Mass 349.135 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111014955
Version
Author
Maintainer
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MetadataPublished 2023-11-10
Related Molecule
  • (2-ethoxy-2-oxoethyl)-triphenylphosphanium
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-1313181914 Mcule
    ZINC000060272221 ZINC
    EPEFUB CCDC
    J231.946B Nikkaji
    73732 PubChem
    16111873 PubChem: Thomson Pharma
    The data in this table is sourced from UniChem at EBI.