Dataset

Bis(2-butoxyethyl) 3?-hydroxy-2-butoxyethyl phosphate ; LC-ESI-QTOF; MS2; CE: 35eV; R=7000; [M+H]+

This MassBank record with Accession MSBNK-Antwerp_Univ-AN119407 contains the MS2 mass spectrum of Bis(2-butoxyethyl) 3?-hydroxy-2-butoxyethyl phosphate with the InChIkey ZYWDPVGRFHQPGL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C18H39O8P/c1-4-6-9-21-12-15-24-27(20,25-16-13-22-10-7-5-2)26-17-14-23-11-8-18(3)19/h18-19H,4-17H2,1-3H3
SMILES CCCCOCCOP(=O)(OCCOCCCC)OCCOCCC(C)O
InChI Key ZYWDPVGRFHQPGL-UHFFFAOYSA-N
Molecular Formula C18H39O8P
Exact Mass 414.238 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN119407
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MetadataPublished 2021-08-11
Related Molecule
  • bis(2-butoxyethyl) 2-(3-hydroxybutoxy)ethyl phosphate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    134818028 PubChem
    The data in this table is sourced from UniChem at EBI.