Dataset

Phosphatidylcholine 15:0-18:2

This MassBank record with Accession MSBNK-Chubu_Univ-UT002988 contains the MS3 mass spectrum of Phosphatidylcholine 15:0-18:2 with the InChIkey OKOJVIBHOSGPIV-JSCMVKKRSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C41H78NO8P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42(3,4)5)37-47-40(43)33-31-29-27-25-23-19-17-15-13-11-9-7-2/h22,24,28,30,39H,6-21,23,25-27,29,31-38H2,1-5H3/b24-22-,30-28-
SMILES C(CCCCCCCCC(OCC(OC(=O)CCC=CCC=CCCCCCCCCCC)COP(OCC[N+1](C)(C)C)([O-1])=O)=O)CCCCC
InChI Key OKOJVIBHOSGPIV-JSCMVKKRSA-N
Molecular Formula C41H78NO8P
Exact Mass 743.547 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-UT002988
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:47:50.416479
MetadataModified 2024-01-11T12:47:50.594563
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
134755479 PubChem
The data in this table is sourced from UniChem at EBI.