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3-(3-keto-2-propargyl-cyclopentyl)propionic acid methyl ester
SpectraBase Compound ID HbgweuK0o0m
InChI InChI=1S/C12H16O3/c1-3-4-10-9(5-7-11(10)13)6-8-12(14)15-2/h1,9-10H,4-8H2,2H3
InChIKey BCYJOGGTKDSPJD-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 zLgr0t7EZO
Name 3-(3-keto-2-propargyl-cyclopentyl)propionic acid methyl ester
CAS Registry Number 92486-13-0
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/h1,9-10H,4-8H2,2H3
InChIKey BCYJOGGTKDSPJD-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C1(=O)CCC(C1CC#C)CCC(=O)OC
SPLASH splash10-0006-9300000000-f576a7b5d809d358dcc8
Source of Spectrum CM-1999-12904-0
Synonyms 3-(3-Oxo-2-prop-2-ynyl-cyclopentyl)-propionic acid, methyl ester 3-(3-oxo-2-prop-2-ynylcyclopentyl)propanoic acid methyl ester Methyl 3-(3-oxidanylidene-2-prop-2-ynyl-cyclopentyl)propanoate Methyl 3-(3-oxo-2-prop-2-ynyl-cyclopentyl)propanoate Methyl 3-[3-oxo-2-(2-propynyl)cyclopentyl]propanoate
Wiley ID 475258