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(2S)-Dimethyl 2-hydroxypentanedioate
SpectraBase Compound ID L3I2LodMEYr
InChI InChI=1S/C7H12O5/c1-11-6(9)4-3-5(8)7(10)12-2/h5,8H,3-4H2,1-2H3/t5-/m0/s1
InChIKey SHBLBMNYOOCEFM-YFKPBYRVSA-N
Mol Weight 176.17 g/mol
Molecular Formula C7H12O5
Exact Mass 176.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ccp6TvP7EWS
Name (2S)-Dimethyl 2-hydroxypentanedioate
Alternate Name(s) (2S)-2-hydroxypentanedioic acid dimethyl ester Dimethyl (2S)-2-hydroxypentanedioate Dimethyl (2S)-2-oxidanylpentanedioate
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Formula C7H12O5
InChI InChI=1S/C7H12O5/c1-11-6(9)4-3-5(8)7(10)12-2/h5,8H,3-4H2,1-2H3/t5-/m0/s1
InChIKey SHBLBMNYOOCEFM-YFKPBYRVSA-N
Molecular Weight 176.168 g/mol
SMILES O[C@](C(=O)OC)(CCC(=O)OC)[H]
SPLASH splash10-000i-9200000000-c73f301cccc693ec9129
Source of Spectrum F-65-4674-9
Wiley ID 1680720