Dataset

Ethephon; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M-H]-

This MassBank record with Accession MSBNK-Eawag-EQ00348253 contains the MS2 mass spectrum of Ethephon with the InChIkey UDPGUMQDCGORJQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)
SMILES C(CCl)P(=O)(O)O
InChI Key UDPGUMQDCGORJQ-UHFFFAOYSA-N
Molecular Formula C2H6ClO3P
Exact Mass 143.974 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-Eawag-EQ00348253
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Maintainer
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MetadataPublished 2024-06-14
Related Molecule
  • 2-chloroethylphosphonic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1895474 ChEMBL
    C18399 KEGG Ligand
    52741 ChEBI
    HMDB0252014 Human Metabolome Database
    J1.864C Nikkaji
    29374 Brenda
    MCULE-4131416773 Mcule
    DTXSID7024085 EPA CompTox Dashboard
    SCHEMBL37574 SureChEMBL
    CB5210031 ChemicalBook
    ZINC000003957753 ZINC
    27982 PubChem
    14842988 PubChem: Thomson Pharma
    16672-87-0 ACToR
    11672-87-0 ACToR
    PD156625 ProbesDrugs
    XU5R5VQ87S FDA SRS
    509800 eMolecules
    The data in this table is sourced from UniChem at EBI.