Dataset

FA 16:3+1O

This MassBank record with Accession MSBNK-RIKEN-PR309072 contains the MS2 mass spectrum of FA 16:3+1O with the InChIkey WIJWBOWLVOOYFR-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C16H26O3/c1-2-3-5-9-14-13(11-12-15(14)17)8-6-4-7-10-16(18)19/h3,5,13-14H,2,4,6-12H2,1H3,(H,18,19)
SMILES O=C(O)CCCCCC1CCC(=O)C1(CC=CCC)
InChI Key WIJWBOWLVOOYFR-UHFFFAOYSA-N
Molecular Formula C16H26O3
Exact Mass 266.381 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-PR309072
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:39:07.030153
MetadataModified 2024-01-11T20:39:07.231279
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
54432406 PubChem
SCHEMBL8086648 SureChEMBL
The data in this table is sourced from UniChem at EBI.