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2-[(2E)-3-keto-2-pentylidene-cyclopentyl]acetic acid methyl ester
SpectraBase Compound ID Jf9xiIZdhL2
InChI InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h6,10H,3-5,7-9H2,1-2H3/b11-6+
InChIKey BJWUCYNWZYDBHN-IZZDOVSWSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2opp6RZepv
Name 2-[(2E)-3-keto-2-pentylidene-cyclopentyl]acetic acid methyl ester
Alternate Name(s) 2-[(2E)-3-oxo-2-pentylidenecyclopentyl]acetic acid methyl ester Methyl 2-[(2E)-3-oxidanylidene-2-pentylidene-cyclopentyl]ethanoate Methyl 2-[(2E)-3-oxo-2-pentylidene-cyclopentyl]acetate
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Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h6,10H,3-5,7-9H2,1-2H3/b11-6+
InChIKey BJWUCYNWZYDBHN-IZZDOVSWSA-N
Molecular Weight 224.300 g/mol
SMILES C1(\C(C(CC1)=O)=C/CCCC)CC(=O)OC
SPLASH splash10-0zou-8920000000-c18990fbc8ce3fac3fa2
Source of Spectrum C-88-3080-0
Wiley ID 1590497