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Ethyl 2-ethyl-3-hydroxy-3,5-dimethylhexanoate
SpectraBase Compound ID Hu1wPCGbKlR
InChI InChI=1S/C12H24O3/c1-6-10(11(13)15-7-2)12(5,14)8-9(3)4/h9-10,14H,6-8H2,1-5H3
InChIKey CBJYBHOQNWOSNQ-UHFFFAOYSA-N
Mol Weight 216.32 g/mol
Molecular Formula C12H24O3
Exact Mass 216.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KksmD2hXdoi
Name Ethyl 2-ethyl-3-hydroxy-3,5-dimethylhexanoate
Alternate Name(s) 2-Ethyl-3-hydroxy-3,5-dimethylhexanoic acid ethyl ester Ethyl 2-ethyl-3-hydroxy-3,5-dimethyl-hexanoate Ethyl 2-ethyl-3,5-dimethyl-3-oxidanyl-hexanoate
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Formula C12H24O3
InChI InChI=1S/C12H24O3/c1-6-10(11(13)15-7-2)12(5,14)8-9(3)4/h9-10,14H,6-8H2,1-5H3
InChIKey CBJYBHOQNWOSNQ-UHFFFAOYSA-N
Molecular Weight 216.321 g/mol
SMILES OC(C(C(=O)OCC)CC)(CC(C)C)C
SPLASH splash10-0s5c-6900000000-54f1f858f4a93fd1e04f
Source of Spectrum K-127-2282-13
Wiley ID 1215625