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2-[4-(4-METHOXYPHENYL)-CYCLOHEXYLIDEN]-PROPANOIC-ACID
SpectraBase Compound ID 3tQ1sF53GtG
InChI InChI=1S/C16H20O3/c1-11(16(17)18)12-3-5-13(6-4-12)14-7-9-15(19-2)10-8-14/h7-10,13H,3-6H2,1-2H3,(H,17,18)/b12-11-
InChIKey PJYUAKZOEOJNRF-QXMHVHEDSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GlMgfVEHkoy
Name 2-[4-(4-METHOXYPHENYL)-CYCLOHEXYLIDEN]-PROPANOIC-ACID
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-11(16(17)18)12-3-5-13(6-4-12)14-7-9-15(19-2)10-8-14/h7-10,13H,3-6H2,1-2H3,(H,17,18)/b12-11-
InChIKey PJYUAKZOEOJNRF-QXMHVHEDSA-N
Literature Reference Author A.FRIESE,K.HELL-MOMENI,I.ZUENDORF,T.WINCKLER,T.DINGERMANN,G. DANNHARDT
Literature Reference Citation J.MED.CHEM.,45,1535(2002)
Literature Reference DOI 10.1021/jm011101q
Molecular Weight 260.333 g/mol
Sample ID 40951
Solvent DMSO-D6