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3-oxo-2,2,4-Trimethylvaleric acid, ethyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

3-oxo-2,2,4-Trimethylvaleric acid, ethyl ester
SpectraBase Compound ID hkUGEJPcSX
InChI InChI=1S/C10H18O3/c1-6-13-9(12)10(4,5)8(11)7(2)3/h7H,6H2,1-5H3
InChIKey IINVHMMMAUHNDG-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AhrmAvm8nfc
Name 3-OXO-2,2,4-TRIMETHYLVALERIC ACID, ETHYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-6-13-9(12)10(4,5)8(11)7(2)3/h7H,6H2,1-5H3
InChIKey IINVHMMMAUHNDG-UHFFFAOYSA-N
Molecular Weight 186.25
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms VALERIC ACID, 3-OXO-2,2,4-TRIMETHYL-, ETHYL ESTER