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METHYL-(1R*,3S*)-3-METHYL-3-(3-OXOBUTYL)-4-OXO-CYClOHEXAN-1-CARBOXYLATE
SpectraBase Compound ID HqsBqGEKi7X
InChI InChI=1S/C13H20O4/c1-9(14)6-7-13(2)8-10(12(16)17-3)4-5-11(13)15/h10H,4-8H2,1-3H3/t10-,13+/m1/s1
InChIKey YCLCQYVRYLSVEI-MFKMUULPSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5DuU77wiMfR
Name METHYL-(1R*,3S*)-3-METHYL-3-(3-OXOBUTYL)-4-OXO-CYClOHEXAN-1-CARBOXYLATE
Compound Number 41
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-9(14)6-7-13(2)8-10(12(16)17-3)4-5-11(13)15/h10H,4-8H2,1-3H3/t10-,13+/m1/s1
InChIKey YCLCQYVRYLSVEI-MFKMUULPSA-N
Literature Reference Author D.E.WARD,Y.GAI
Literature Reference Citation CAN.J.CHEM.,75,681(1997)
Literature Reference DOI 10.1139/v97-082
Molecular Weight 240.299 g/mol
Solvent CDCl3
Source File Reference UWCP5034