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Methyl 4-(3-oxo-2-pent-2-enylcyclopentyl)butyrate
SpectraBase Compound ID FVMpTJfnbpD
InChI InChI=1S/C15H24O3/c1-3-4-5-8-13-12(10-11-14(13)16)7-6-9-15(17)18-2/h4-5,12-13H,3,6-11H2,1-2H3/b5-4+/t12-,13+/m0/s1
InChIKey NFKJKGVJZFWDKI-QITAHTHBSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dPNOIzD6rq
Name Methyl 4-(3-oxo-2-pent-2-enylcyclopentyl)butyrate
Alternate Name(s) 4-[(1S,2R)-3-Oxo-2-((E)-pent-2-enyl)-cyclopentyl]-butyric acid methyl ester Methyl 4-{3-oxo-2-[(2E)-2-pentenyl]cyclopentyl}butanoate Methyl 5-(pent-2'-enyl)-4-oxocyclopentyl-1-butyrate Methyl ester of opc-4-:o
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Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-3-4-5-8-13-12(10-11-14(13)16)7-6-9-15(17)18-2/h4-5,12-13H,3,6-11H2,1-2H3/b5-4+/t12-,13+/m0/s1
InChIKey NFKJKGVJZFWDKI-QITAHTHBSA-N
Molecular Weight 252.354 g/mol
SMILES C1([C@@]([C@@](CCCC(=O)OC)(CC1)[H])(C\C=C\CC)[H])=O
SPLASH splash10-0f89-9830000000-95bfa3b3e9b595094aa6
Source of Spectrum KC-0-3554-3
Wiley ID 823870