(+/-)9-HpODE

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Systematic / IUPAC Name: (10E,12Z)-9-Hydroperoxy-10,12-octadecadienoic acid

ID: Reference9923

Other Names: (10E,12Z)-9-Hydroperoxyoctadeca-10,12-dienoic acid;
(E,Z)-9-Hydroperoxy-10,12-octadecadienoic acid;
10,12-Octadecadienoic acid, 9-hydroperoxy-, (E,Z)-

Formula: C18H32O4

Class: Endogenous Metabolites

Spectral Data

(+/-)9-HpODE mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion with FAIMS
No. of Spectral Trees 1
No. of Spectra 427
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 9/11/2020 11:41:02 AM
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Identificators

InChI InChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/b8-6-,14-11+
InChI Key JGUNZIWGNMQSBM-ZJHFMPGASA-N
Canonical SMILES CCCCCC=CC=CC(CCCCCCCC(=O)O)OO
CAS 5502910
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Other Names (10E,12Z)-9-Hydroperoxyoctadeca-10,12-dienoic acid;
(E,Z)-9-Hydroperoxy-10,12-octadecadienoic acid;
10,12-Octadecadienoic acid, 9-hydroperoxy-, (E,Z)-

In Other Databases

PubChem 6439847
ChemIDPlus 005502910
HMDb HMDB0006940
ChemSpider 4944227