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(2S,3S)-3-hydroxy-2-methyl-7-octynoic acid methyl ester
SpectraBase Compound ID E88LUqL0sft
InChI InChI=1S/C10H16O3/c1-4-5-6-7-9(11)8(2)10(12)13-3/h1,8-9,11H,5-7H2,2-3H3/t8-,9-/m0/s1
InChIKey LIMIMXSIKOFOGJ-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 8MCz8eeGGOs
Name (2S,3S)-3-hydroxy-2-methyl-7-octynoic acid methyl ester
Alternate Name(s) (2S,3S)-3-hydroxy-2-methyl-oct-7-ynoic acid methyl ester Methyl (2S,3S)-2-methyl-3-oxidanyl-oct-7-ynoate Methyl (2S,3S)-3-hydroxy-2-methyl-oct-7-ynoate
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Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-4-5-6-7-9(11)8(2)10(12)13-3/h1,8-9,11H,5-7H2,2-3H3/t8-,9-/m0/s1
InChIKey LIMIMXSIKOFOGJ-IUCAKERBSA-N
Molecular Weight 184.235 g/mol
SMILES O[C@]([C@@](C(=O)OC)(C)[H])(CCCC#C)[H]
SPLASH splash10-00kr-9500000000-f30d1a3cdaf34a2c0e5c
Source of Spectrum C-118-11642-16
Wiley ID 760066