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Ethyl (3S)-4-chloro-3-hydroxybutanoate

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Ethyl (3S)-4-chloro-3-hydroxybutanoate
SpectraBase Compound ID 9k4rpSmrEQG
InChI InChI=1S/C6H11ClO3/c1-2-10-6(9)3-5(8)4-7/h5,8H,2-4H2,1H3/t5-/m0/s1
InChIKey ZAJNMXDBJKCCAT-YFKPBYRVSA-N
Mol Weight 166.6 g/mol
Molecular Formula C6H11ClO3
Exact Mass 166.039672 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HL35BccUHHY
Name Ethyl (S)-(-)-4-chloro-3-hydroxybutyrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 460524
CAS Registry Number 86728-85-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11ClO3
InChI InChI=1S/C6H11ClO3/c1-2-10-6(9)3-5(8)4-7/h5,8H,2-4H2,1H3/t5-/m0/s1
InChIKey ZAJNMXDBJKCCAT-YFKPBYRVSA-N
Observed nucleus 13C
Purity 96%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (S)-4-Chloro-3-hydroxy-n-butyric Acid Ethyl Ester ethyl (S)-4-chloro-3-hydroxybutanoate
Wiley ID SIAL_13CNMR_010139