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3-METHYL-4,4,4-TRICHLOROBUTYRIC ACID
SpectraBase Compound ID 1080aSrctjp
InChI InChI=1S/C5H7Cl3O2/c1-3(2-4(9)10)5(6,7)8/h3H,2H2,1H3,(H,9,10)
InChIKey ZSAUFTRMUDCPGS-UHFFFAOYSA-N
Mol Weight 205.47 g/mol
Molecular Formula C5H7Cl3O2
Exact Mass 203.951163 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LhrYW0O8cvg
Name 4,4,4-Trichloro-3-methyl-butanoic acid
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H7Cl3O2
InChI InChI=1S/C5H7Cl3O2/c1-3(2-4(9)10)5(6,7)8/h3H,2H2,1H3,(H,9,10)
InChIKey ZSAUFTRMUDCPGS-UHFFFAOYSA-N
Literature Reference S.E. De Lazlo, P.G. Willard, J. Am. Chem. Soc. 107, 199 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3