Dataset

Phosphatidylethanolamine alkyl 20:0-18:2

This MassBank record with Accession MSBNK-Chubu_Univ-UT001928 contains the MS2 mass spectrum of Phosphatidylethanolamine alkyl 20:0-18:2 with the InChIkey LJTFYNCGYVJVFV-QIPJBBGZSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C43H84NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-38-48-40-42(41-50-52(46,47)49-39-37-44)51-43(45)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h24,26,30,32,42H,3-23,25,27-29,31,33-41,44H2,1-2H3,(H,46,47)/b26-24-,32-30-
SMILES C(CCCCCCCCCCCCCCOCC(COP(OCCN)(O)=O)OC(CCC=CCC=CCCCCCCCCCC)=O)CCCCC
InChI Key LJTFYNCGYVJVFV-QIPJBBGZSA-N
Molecular Formula C43H84NO7P
Exact Mass 757.599 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-UT001928
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:46:46.716810
MetadataModified 2024-01-11T12:46:46.869337
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134746892 PubChem
The data in this table is sourced from UniChem at EBI.