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3,3-dichlorobutyric acid, methyl ester
SpectraBase Compound ID BnFlVaMfuiT
InChI InChI=1S/C5H8Cl2O2/c1-5(6,7)3-4(8)9-2/h3H2,1-2H3
InChIKey NYIDWPOSGNPCLN-UHFFFAOYSA-N
Mol Weight 171.02 g/mol
Molecular Formula C5H8Cl2O2
Exact Mass 169.990135 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fwqy5cEXlP9
Name 3,3-Dichloro-butanoic acid, methyl ester
CAS Registry Number 30693-79-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H8Cl2O2
InChI InChI=1S/C5H8Cl2O2/c1-5(6,7)3-4(8)9-2/h3H2,1-2H3
InChIKey NYIDWPOSGNPCLN-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference M. Pitkanen, Org. Magn. Resonance 18, 165 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4