Dataset

(Z)-Octadec-9-enoic acid, Pamolyn, Fat Acid, cis-9-Octadecenoic acid, Oleate, Oleic acid, Elainic acid

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS031501 contains the MS2 mass spectrum of (Z)-Octadec-9-enoic acid, Pamolyn, Fat Acid, cis-9-Octadecenoic acid, Oleate, Oleic acid, Elainic acid with the InChIkey ZQPPMHVWECSIRJ-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)
SMILES	CCCCCCCCC=CCCCCCCCC(=O)O
InChI Key	ZQPPMHVWECSIRJ-UHFFFAOYSA-N
Molecular Formula	C18H34O2
Exact Mass	282.468 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS031501
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T21:14:19.166133
MetadataModified	2025-02-09T19:06:34.524033
MetadataPublished	2009-02-09

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
965	PubChem
PD099142	ProbesDrugs
MTBLC36021	Metabolights
HMDB0062703	Human Metabolome Database
SCHEMBL1139	SureChEMBL
MCULE-9547538729	Mcule
36021	ChEBI
DTXSID7048118	EPA CompTox Dashboard
OLECAC	CCDC
The data in this table is sourced from UniChem at EBI.