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2,5-dioxo-1-methylcyclopentaneacetic acid, methyl ester
SpectraBase Compound ID FqLLlXsxTHD
InChI InChI=1S/C9H12O4/c1-9(5-8(12)13-2)6(10)3-4-7(9)11/h3-5H2,1-2H3
InChIKey RRRPIIDJTCRPDM-UHFFFAOYSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DOqLXklckn2
Name 2,5-DIOXO-1-METHYLCYCLOPENTANEACETIC ACID, METHYL ESTER
Source of Sample H. Schick, Academy of Sciences, Berlin, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-9(5-8(12)13-2)6(10)3-4-7(9)11/h3-5H2,1-2H3
InChIKey RRRPIIDJTCRPDM-UHFFFAOYSA-N
Melting Point 95-97C
Molecular Weight 184.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CYCLOPENTANEACETIC ACID, 2,5-DIOXO- 1-METHYL-, METHYL ESTER