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Ethyl 4-chloroacetoacetate

View entire compound with spectra: 2 NMR, 5 FTIR, 2 Raman, 2 MS (GC), and 2 Near IR

Ethyl 4-chloroacetoacetate
SpectraBase Compound ID L0D45WRKwkF
InChI InChI=1S/C6H9ClO3/c1-2-10-6(9)3-5(8)4-7/h2-4H2,1H3
InChIKey OHLRLMWUFVDREV-UHFFFAOYSA-N
Mol Weight 164.59 g/mol
Molecular Formula C6H9ClO3
Exact Mass 164.024022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSKmDZim8a1
Name Ethyl 4-chloro-3-oxobutanoate
Alternate Name(s) 4-Chloro-3-keto-butyric acid ethyl ester 4-Chloro-3-oxobutanoic acid ethyl ester 4-Chloroacetoacetic acid ethyl ester Acetoacetic acid, 4-chloro-, ethyl ester Butanoic acid, 4-chloro-3-oxo-, ethyl ester Ethyl .gamma.-chloroacetoacetate Ethyl 4-chloranyl-3-oxidanylidene-butanoate Ethyl 4-chloroacetoacetate Ethyl gamma-chloroacetoacetate BRN 1761275 CCRIS 6791 EINECS 211-317-0
CAS Registry Number 638-07-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9ClO3
InChI InChI=1S/C6H9ClO3/c1-2-10-6(9)3-5(8)4-7/h2-4H2,1H3
InChIKey OHLRLMWUFVDREV-UHFFFAOYSA-N
Molecular Weight 164.588 g/mol
SMILES C(C(CC(=O)OCC)=O)Cl
SPLASH splash10-016u-9300000000-00b462c8ff36acc521db
Source of Spectrum W5-0-0-0
Wiley ID 1159807