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1-Cyclopentene-1-propanoic acid, 3-oxo-2-(2-propenyl)-, methyl ester
SpectraBase Compound ID 5RR4jPbXTKy
InChI InChI=1S/C12H16O3/c1-3-4-10-9(5-7-11(10)13)6-8-12(14)15-2/h3H,1,4-8H2,2H3
InChIKey DAVWYLNPBCBMQE-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DcftfiILC2s
Name 1-Cyclopentene-1-propanoic acid, 3-oxo-2-(2-propenyl)-, methyl ester
Alternate Name(s) Methyl 3-(2-allyl-3-oxo-1-cyclopenten-1-yl)propanoate Methyl 3-(2-allyl-3-oxocyclopent-1-enyl)propionate
CAS Registry Number 108546-64-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-3-4-10-9(5-7-11(10)13)6-8-12(14)15-2/h3H,1,4-8H2,2H3
InChIKey DAVWYLNPBCBMQE-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C1(=C(CCC1=O)CCC(=O)OC)CC=C
SPLASH splash10-0a4j-0980000000-5ba2e462ea8f9009e629
Source of Spectrum KC-1988-1398-4
Wiley ID 1206926