Dataset

Phosphatidylethanolamine 18:1-20:1

This MassBank record with Accession MSBNK-Chubu_Univ-UT001385 contains the MS2 mass spectrum of Phosphatidylethanolamine 18:1-20:1 with the InChIkey UVYKYAJJWJKGHK-SZDCHMHBSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C43H82NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h29-32,41H,3-28,33-40,44H2,1-2H3,(H,47,48)/b31-29-,32-30-
SMILES C(CC=CCCC(=O)OC(COC(CCC=CCCCCCCCCCCCCC)=O)COP(O)(=O)OCCN)CCCCCCCCCCCCC
InChI Key UVYKYAJJWJKGHK-SZDCHMHBSA-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-UT001385
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:58:19.146924
MetadataModified 2025-02-09T08:59:42.383447
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134771862 PubChem
The data in this table is sourced from UniChem at EBI.