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5-oxohexanoic acid

View entire compound with spectra: 4 NMR, 5 FTIR, 1 Raman, and 7 MS (GC)

5-oxohexanoic acid
SpectraBase Compound ID 9AivOT1YpvP
InChI InChI=1S/C6H10O3/c1-5(7)3-2-4-6(8)9/h2-4H2,1H3,(H,8,9)
InChIKey MGTZCLMLSSAXLD-UHFFFAOYSA-N
Mol Weight 130.14 g/mol
Molecular Formula C6H10O3
Exact Mass 130.062994 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K2nDFJXGuVG
Name 5-OXOHEXANOIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Boiling Point 274-275C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O3
InChI InChI=1S/C6H10O3/c1-5(7)3-2-4-6(8)9/h2-4H2,1H3,(H,8,9)
InChIKey MGTZCLMLSSAXLD-UHFFFAOYSA-N
Melting Point 13-14C
Molecular Weight 130.14
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms HEXANOIC ACID, 5-OXO-, BUTYRIC ACID, 4-ACETYL-,