Dataset

1-tridecanoyl-sn-glycero-3-phosphoethanolamine

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N106014_E098 contains the MS2 mass spectrum of 1-tridecanoyl-sn-glycero-3-phosphoethanolamine with the InChIkey IJTWJFQIBBDJJI-QGZVFWFLSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C18H38NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-18(21)24-15-17(20)16-26-27(22,23)25-14-13-19/h17,20H,2-16,19H2,1H3,(H,22,23)/t17-/m1/s1
SMILES [C@](COP(=O)(O)OCCN)([H])(O)COC(CCCCCCCCCCCC)=O
InChI Key IJTWJFQIBBDJJI-QGZVFWFLSA-N
Molecular Formula C18H38NO7P
Exact Mass 411.239 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N106014_E098
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:29:51.906047
MetadataModified 2024-01-11T09:29:52.050375
MetadataPublished 2022-04-07
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
42607463 PubChem
168242 ChEBI
136212574 PubChem
SLM:000030179 SwissLipids
ZINC000102190945 ZINC
LMGP02050007 LipidMaps
The data in this table is sourced from UniChem at EBI.