Dataset

Phosphatidylethanolamine 20:0-18:2

This MassBank record with Accession MSBNK-Chubu_Univ-UT001889 contains the MS2 mass spectrum of Phosphatidylethanolamine 20:0-18:2 with the InChIkey VWYTUCQACXRPSI-QIPJBBGZSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C43H82NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44)52-43(46)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h24,26,30,32,41H,3-23,25,27-29,31,33-40,44H2,1-2H3,(H,47,48)/b26-24-,32-30-
SMILES OP(=O)(OCCN)OCC(COC(=O)CCCCCCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCCCCCCCCCC
InChI Key VWYTUCQACXRPSI-QIPJBBGZSA-N
Molecular Formula C43H82NO8P
Exact Mass 771.578 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT001889
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:47:10.981495
MetadataModified 2024-01-11T12:47:11.138711
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134774665 PubChem
The data in this table is sourced from UniChem at EBI.