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(1R,3R/1R,3S)-3-(3-ISOPROPYL-1-METHYL-2-OXOCYCLOPENTYL)-PROPANOIC-ACID
SpectraBase Compound ID JhYbN4y2Vsc
InChI InChI=1S/C12H20O3/c1-8(2)9-4-6-12(3,11(9)15)7-5-10(13)14/h8-9H,4-7H2,1-3H3,(H,13,14)/t9?,12-/m1/s1
InChIKey PBUSBGSFZKHMSE-FFFFSGIJSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPNLpNoauA6
Name (1R,3R/1R,3S)-3-(3-ISOPROPYL-1-METHYL-2-OXOCYCLOPENTYL)-PROPANOIC-ACID
Compound Number 35B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-8(2)9-4-6-12(3,11(9)15)7-5-10(13)14/h8-9H,4-7H2,1-3H3,(H,13,14)/t9?,12-/m1/s1
InChIKey PBUSBGSFZKHMSE-FFFFSGIJSA-N
Literature Reference Author E.DREGE,C.TOMINIAUX,G.MAORGANT,D.DESMAELE
Literature Reference Citation EUR.J.ORG.CHEM.,4825(2006)
Molecular Weight 212.289 g/mol
Sample ID 44291
Solvent CDCl3