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trans-5-Hydroxy-2-methyl-1-(4-hydroxybut-2-yl)cyclopentan-3-one
SpectraBase Compound ID KRFHZPQXYAi
InChI InChI=1S/C10H18O3/c1-6(3-4-11)10-7(2)8(12)5-9(10)13/h6-7,9-11,13H,3-5H2,1-2H3/t6-,7+,9?,10-/m1/s1
InChIKey MHJTYXKAHKIFMS-YFWYSBGISA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CA4OoRBSiK2
Name trans-5-Hydroxy-2-methyl-1-(4-hydroxybut-2-yl)cyclopentan-3-one
Alternate Name(s) (2R,3R)-4-Hydroxy-3-((R)-3-hydroxy-1-methyl-propyl)-2-methyl-cyclopentanone (2S,3S)-4-hydroxy-3-[(1S)-3-hydroxy-1-methylpropyl]-2-methylcyclopentanone (2R,3R)-4-hydroxy-3-[(2R)-4-hydroxybutan-2-yl]-2-methyl-1-cyclopentanone (2R,3R)-4-hydroxy-3-[(2R)-4-hydroxybutan-2-yl]-2-methylcyclopentan-1-one (2R,3R)-2-methyl-4-oxidanyl-3-[(2R)-4-oxidanylbutan-2-yl]cyclopentan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-6(3-4-11)10-7(2)8(12)5-9(10)13/h6-7,9-11,13H,3-5H2,1-2H3/t6-,7+,9?,10-/m1/s1
InChIKey MHJTYXKAHKIFMS-YFWYSBGISA-N
Molecular Weight 186.251 g/mol
SMILES OC1CC([C@@]([C@]1([C@@](CCO)(C)[H])[H])(C)[H])=O
SPLASH splash10-004i-0900000000-c4288e449e7ac39a7791
Source of Spectrum J-63-2330-29
Wiley ID 1182916