Dataset

FA 18:2+3O

This MassBank record with Accession MSBNK-RIKEN-PR309099 contains the MS2 mass spectrum of FA 18:2+3O with the InChIkey MKYUCBXUUSZMQB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C18H32O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h3,7,13-17,19-21H,2,4-6,8-12H2,1H3,(H,22,23)
SMILES O=C(O)CCCCCCCC(O)C=CC(O)C(O)CC=CCC
InChI Key MKYUCBXUUSZMQB-UHFFFAOYSA-N
Molecular Formula C18H32O5
Exact Mass 328.449 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-RIKEN-PR309099
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T19:50:31.214362
MetadataModified 2025-02-09T18:27:42.131546
MetadataPublished 2019-03-28
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
181306 ChEBI
72732143 PubChem
The data in this table is sourced from UniChem at EBI.