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(2R,4S)-5.Acetoxy-2,4-dimethylpentan-1-ol
SpectraBase Compound ID 3mlmJxlWjyG
InChI InChI=1S/C9H18O3/c1-7(5-10)4-8(2)6-12-9(3)11/h7-8,10H,4-6H2,1-3H3/t7-,8+/m1/s1
InChIKey PPWUGJRYPLAOPM-SFYZADRCSA-N
Mol Weight 174.24 g/mol
Molecular Formula C9H18O3
Exact Mass 174.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMc5LIlPadB
Name (2R,4S)-5.Acetoxy-2,4-dimethylpentan-1-ol
Alternate Name(s) Acetic acid (2S,4R)-5-hydroxy-2,4-dimethyl-pentyl ester Acetic acid [(2S,4R)-5-hydroxy-2,4-dimethylpentyl] ester [(2S,4R)-5-hydroxy-2,4-dimethylpentyl] acetate [(2S,4R)-5-hydroxy-2,4-dimethyl-pentyl] acetate [(2S,4R)-2,4-dimethyl-5-oxidanyl-pentyl] ethanoate
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Formula C9H18O3
InChI InChI=1S/C9H18O3/c1-7(5-10)4-8(2)6-12-9(3)11/h7-8,10H,4-6H2,1-3H3/t7-,8+/m1/s1
InChIKey PPWUGJRYPLAOPM-SFYZADRCSA-N
Molecular Weight 174.240 g/mol
SMILES OC[C@@](C[C@@](COC(=O)C)(C)[H])(C)[H]
SPLASH splash10-0a4i-9000000000-cbc212d54c0085691ce9
Source of Spectrum G2-4-377-3
Wiley ID 1661633