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(2RS)-2-[(1RS)-3-OXO-CYClOHEXYL]-PROPANOIC-ACID
SpectraBase Compound ID 5ds3MyfnITd
InChI InChI=1S/C9H14O3/c1-6(9(11)12)7-3-2-4-8(10)5-7/h6-7H,2-5H2,1H3,(H,11,12)/t6-,7-/m1/s1
InChIKey ZBGNQKQMJHXXRQ-RNFRBKRXSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A4hY94H4zlb
Name (2RS)-2-[(1RS)-3-OXO-CYClOHEXYL]-PROPANOIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-6(9(11)12)7-3-2-4-8(10)5-7/h6-7H,2-5H2,1H3,(H,11,12)/t6-,7-/m1/s1
InChIKey ZBGNQKQMJHXXRQ-RNFRBKRXSA-N
Literature Reference Author S.TANIMORI,Y.MITANI,R.HONDA,A.MATSUO,M.NAKAYAMA
Literature Reference Citation CHEM.LETT.,763(1986)
Literature Reference DOI 10.1246/cl.1986.763
Molecular Weight 170.208 g/mol
Solvent CDCl3
Source File Reference UWWR5041