Dataset

Phosphatidylethanolamine 19:0-20:3

This MassBank record with Accession MSBNK-Chubu_Univ-UT002619 contains the MS2 mass spectrum of Phosphatidylethanolamine 19:0-20:3 with the InChIkey WHRINFUMSAOXIM-UEZFOCAYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C44H82NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45)40-50-43(46)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h19,21,25,27,31,33,42H,3-18,20,22-24,26,28-30,32,34-41,45H2,1-2H3,(H,48,49)/b21-19-,27-25-,33-31-
SMILES C(COP(OCCN)(O)=O)(COC(CCCCCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCCCCCCCCC
InChI Key WHRINFUMSAOXIM-UEZFOCAYSA-N
Molecular Formula C44H82NO8P
Exact Mass 783.578 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-UT002619
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:46:39.815270
MetadataModified 2024-01-11T12:46:39.984604
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134775841 PubChem
The data in this table is sourced from UniChem at EBI.