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(R)-Methyl-[2-hydroxy-2-methyl-4-oxo-4-(2,4-dichlorophenyl)]-butanoate
SpectraBase Compound ID IEynrOKc9t1
InChI InChI=1S/C12H12Cl2O4/c1-12(17,11(16)18-2)6-10(15)8-4-3-7(13)5-9(8)14/h3-5,17H,6H2,1-2H3/t12-/m1/s1
InChIKey SRTNWWVHCLIXMP-GFCCVEGCSA-N
Mol Weight 291.13 g/mol
Molecular Formula C12H12Cl2O4
Exact Mass 290.011264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pt4f5MAElM
Name (R)-Methyl-[2-hydroxy-2-methyl-4-oxo-4-(2,4-dichlorophenyl)]-butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12Cl2O4
InChI InChI=1S/C12H12Cl2O4/c1-12(17,11(16)18-2)6-10(15)8-4-3-7(13)5-9(8)14/h3-5,17H,6H2,1-2H3/t12-/m1/s1
InChIKey SRTNWWVHCLIXMP-GFCCVEGCSA-N
Literature Reference DOI 10.1021/ol703065x
Molecular Weight 291.130 g/mol
SMILES O[C@](CC(=O)c1c(cc(cc1)Cl)Cl)(C(OC)=O)C
SPLASH splash10-0a4i-0930000000-5a92f314ca7e3deb5d28
Source of Spectrum A1-10-917/SMS11-7h
Synonyms (R)-methyl 4-(2,4-dichlorophenyl)-2-hydroxy-2-methyl-4-oxobutanoate
Wiley ID 1759170