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
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.
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 |
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]- |