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Methyl (2R*,3S*)-2-Butyl-3-hydroxy-4-pentynoate

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Methyl (2R*,3S*)-2-Butyl-3-hydroxy-4-pentynoate
SpectraBase Compound ID GxQv0PF24Id
InChI InChI=1S/C10H16O3/c1-4-6-7-8(9(11)5-2)10(12)13-3/h2,8-9,11H,4,6-7H2,1,3H3/t8-,9-/m0/s1
InChIKey SQEFBIPMLVMLHF-IUCAKERBSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GM5XZPEeqP3
Name Methyl (2R*,3S*)-2-Butyl-3-hydroxy-4-pentynoate
Alternate Name(s) (S)-2-((R)-1-Hydroxy-prop-2-ynyl)-hexanoic acid methyl ester Methyl (2R,3S)-2-butyl-3-hydroxy-4-pentynoate (2S)-2-[(1R)-1-hydroxyprop-2-ynyl]hexanoic acid methyl ester Methyl (2S)-2-[(1R)-1-hydroxyprop-2-ynyl]hexanoate Methyl (2S)-2-[(1R)-1-oxidanylprop-2-ynyl]hexanoate
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Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-4-6-7-8(9(11)5-2)10(12)13-3/h2,8-9,11H,4,6-7H2,1,3H3/t8-,9-/m0/s1
InChIKey SQEFBIPMLVMLHF-IUCAKERBSA-N
Molecular Weight 184.235 g/mol
SMILES O[C@@](C#C)([C@@](C(=O)OC)(CCCC)[H])[H]
SPLASH splash10-0540-9600000000-75467be8fb1aba1487fe
Source of Spectrum J-58-2950-12
Wiley ID 1180692