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2-Chloro-2-[hydroxy(phenyl)methyl]butanoic acid methyl ester
SpectraBase Compound ID DzuIujqEDrG
InChI InChI=1S/C12H15ClO3/c1-3-12(13,11(15)16-2)10(14)9-7-5-4-6-8-9/h4-8,10,14H,3H2,1-2H3
InChIKey SINALYUGFHHQJB-UHFFFAOYSA-N
Mol Weight 242.7 g/mol
Molecular Formula C12H15ClO3
Exact Mass 242.070972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BThD9666ku
Name 2-Chloro-2-[hydroxy(phenyl)methyl]butanoic acid methyl ester
Alternate Name(s) 2-Chloro-2-[hydroxy(phenyl)methyl]butyric acid methyl ester Methyl 2-chloranyl-2-[oxidanyl(phenyl)methyl]butanoate Methyl 2-chloro-2-[hydroxy(phenyl)methyl]butanoate
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Formula C12H15ClO3
InChI InChI=1S/C12H15ClO3/c1-3-12(13,11(15)16-2)10(14)9-7-5-4-6-8-9/h4-8,10,14H,3H2,1-2H3
InChIKey SINALYUGFHHQJB-UHFFFAOYSA-N
Molecular Weight 242.702 g/mol
SMILES OC(C(C(=O)OC)(Cl)CC)c1ccccc1
SPLASH splash10-05di-5900000000-32bf5ff6972464a39b6c
Source of Spectrum SK-26-4119-65524
Wiley ID 867399