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2-[1-(2-oxocyclopentyl)but-3-en-2-yl]propanedioic acid dimethyl ester
SpectraBase Compound ID 5Q7wIb63XXC
InChI InChI=1S/C14H20O5/c1-4-9(8-10-6-5-7-11(10)15)12(13(16)18-2)14(17)19-3/h4,9-10,12H,1,5-8H2,2-3H3
InChIKey JNLNTIWDNSWJCJ-UHFFFAOYSA-N
Mol Weight 268.31 g/mol
Molecular Formula C14H20O5
Exact Mass 268.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LFRVfTZ055j
Name 2-[1-(2-oxocyclopentyl)but-3-en-2-yl]propanedioic acid dimethyl ester
Alternate Name(s) 2-[1-[(2-ketocyclopentyl)methyl]allyl]malonic acid dimethyl ester Dimethyl 2-[1-(2-oxidanylidenecyclopentyl)but-3-en-2-yl]propanedioate Dimethyl 2-[1-(2-oxocyclopentyl)but-3-en-2-yl]propanedioate Dimethyl 2-[1-[(2-oxocyclopentyl)methyl]allyl]propanedioate
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Formula C14H20O5
InChI InChI=1S/C14H20O5/c1-4-9(8-10-6-5-7-11(10)15)12(13(16)18-2)14(17)19-3/h4,9-10,12H,1,5-8H2,2-3H3
InChIKey JNLNTIWDNSWJCJ-UHFFFAOYSA-N
Molecular Weight 268.309 g/mol
SMILES C(C(CC1C(=O)CCC1)C=C)(C(=O)OC)C(=O)OC
SPLASH splash10-05gr-7910000000-87a5882a70891b36a983
Source of Spectrum J-60-4957-5
Wiley ID 1272041