Dataset

Phosphatidylethanolamine 16:1-20:4

This MassBank record with Accession MSBNK-Chubu_Univ-UT001111 contains the MS2 mass spectrum of Phosphatidylethanolamine 16:1-20:4 with the InChIkey TUAWQIYXFSBSNQ-RQDZWXAXSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C41H72NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42)37-47-40(43)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h13,15,18-19,22,24,27-30,39H,3-12,14,16-17,20-21,23,25-26,31-38,42H2,1-2H3,(H,45,46)/b15-13-,19-18-,24-22-,29-27-,30-28-
SMILES C(CCCCCC)=CCC=CCC=CCC=CCCC(OC(COC(CCC=CCCCCCCCCCCC)=O)COP(O)(=O)OCCN)=O
InChI Key TUAWQIYXFSBSNQ-RQDZWXAXSA-N
Molecular Formula C41H72NO8P
Exact Mass 737.500 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-UT001111
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:53:37.967118
MetadataModified 2025-02-09T09:00:42.918817
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134768745 PubChem
The data in this table is sourced from UniChem at EBI.