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Citraconic acid
SpectraBase Compound ID DKGpHsdhsih
InChI InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2-
InChIKey HNEGQIOMVPPMNR-IHWYPQMZSA-N
Mol Weight 130.1 g/mol
Molecular Formula C5H6O4
Exact Mass 130.026609 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6nyPGsF0fU0
Name CITRACONIC ACID
Source of Sample Fluka AG, Buchs, Switzerland
Comments From Z isomer
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6O4
InChI InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2-
InChIKey HNEGQIOMVPPMNR-IHWYPQMZSA-N
Melting Point 91-95C
Molecular Weight 130.10
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20