8-{3-Oxo-2-[(2E)-2-penten-1-yl]-1-cyclopenten-1-yl}octanoic acid

Systematic / IUPAC Name: 8-[3-Oxo-2-[(E)-pent-2-enyl]cyclopenten-1-yl]octanoic acid

ID: Reference7978

Other Names: 8-[3-Oxo-2-(pent-2-en-1-yl)cyclopent-1-enyl]octanoic acid;
1-Cyclopentene-1-octanoic acid, 3-oxo-2-[(2E)-2-penten-1-yl]-

Formula: C18H28O3

Spectral Data

8-{3-Oxo-2-[(2E)-2-penten-1-yl]-1-cyclopenten-1-yl}octanoic acid 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 Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 5/17/2018 11:08:37 AM
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Identificators

InChI InChI=1S/C18H28O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7H,2,4-6,8-14H2,1H3,(H,20,21)/b7-3+
InChI Key RHVWQVSLVMXMBR-XVNBXDOJSA-N
Canonical SMILES CCC=CCC1=C(CCC1=O)CCCCCCCC(=O)O
CAS
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Other Names 8-[3-Oxo-2-(pent-2-en-1-yl)cyclopent-1-enyl]octanoic acid;
1-Cyclopentene-1-octanoic acid, 3-oxo-2-[(2E)-2-penten-1-yl]-

In Other Databases

PubChem 5373082
ChemSpider 4523193