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8-(3-oxo-2-pent-2-ynylcyclopent-1-enyl)octanoic acid

View entire compound with spectra: 1 MS (GC)

8-(3-oxo-2-pent-2-ynylcyclopent-1-enyl)octanoic acid
SpectraBase Compound ID 4oTV1hf4MOR
InChI InChI=1S/C18H26O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h2,4-6,8-14H2,1H3,(H,20,21)
InChIKey IIGNSQNGRUDYSW-UHFFFAOYSA-N
Mol Weight 290.4 g/mol
Molecular Formula C18H26O3
Exact Mass 290.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9224Gc28E80
Name 8-(3-oxo-2-pent-2-ynylcyclopent-1-enyl)octanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h2,4-6,8-14H2,1H3,(H,20,21)
InChIKey IIGNSQNGRUDYSW-UHFFFAOYSA-N
Molecular Weight 290.403 g/mol
SMILES OC(CCCCCCCC1=C(C(CC1)=O)CC#CCC)=O
SPLASH splash10-01r6-1970000000-43ce31b012dbe11b5354
Source of Spectrum F-59-152-11
Wiley ID 1676711