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1-Cyclopentene-1-propanoic acid, 2-(2-ethoxy-2-oxoethyl)-3-oxo-, methyl ester

View entire compound with spectra: 1 MS (GC)

1-Cyclopentene-1-propanoic acid, 2-(2-ethoxy-2-oxoethyl)-3-oxo-, methyl ester
SpectraBase Compound ID 5WRf98raVeI
InChI InChI=1S/C13H18O5/c1-3-18-13(16)8-10-9(4-6-11(10)14)5-7-12(15)17-2/h3-8H2,1-2H3
InChIKey IUMPTUKIRPKYBJ-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Oy5p1UbOY6
Name 1-Cyclopentene-1-propanoic acid, 2-(2-ethoxy-2-oxoethyl)-3-oxo-, methyl ester
Alternate Name(s) Methyl 3-(2-ethoxycarbonylmethyl-3-oxocyclopent-1-enyl)-propionate Methyl 3-[2-(2-ethoxy-2-oxoethyl)-3-oxo-1-cyclopenten-1-yl]propanoate
CAS Registry Number 108546-67-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-3-18-13(16)8-10-9(4-6-11(10)14)5-7-12(15)17-2/h3-8H2,1-2H3
InChIKey IUMPTUKIRPKYBJ-UHFFFAOYSA-N
Molecular Weight 254.282 g/mol
SMILES C1(=C(CCC1=O)CCC(=O)OC)CC(=O)OCC
SPLASH splash10-0a59-0590000000-cb9923a4382c2fcc8466
Source of Spectrum KC-1988-1399-4
Wiley ID 1257511