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benzoic acid [1-methyl-1-(4-methylolphenyl)ethyl] ester
SpectraBase Compound ID 9OLy7E5pCoL
InChI InChI=1S/C17H18O3/c1-17(2,15-10-8-13(12-18)9-11-15)20-16(19)14-6-4-3-5-7-14/h3-11,18H,12H2,1-2H3
InChIKey LGTCFLQGUCSURA-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zgvdyeNVFC
Name benzoic acid [1-methyl-1-(4-methylolphenyl)ethyl] ester
Compound Number 33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18O3
InChI InChI=1S/C17H18O3/c1-17(2,15-10-8-13(12-18)9-11-15)20-16(19)14-6-4-3-5-7-14/h3-11,18H,12H2,1-2H3
InChIKey LGTCFLQGUCSURA-UHFFFAOYSA-N
Literature Reference Author T.NUKADA,A.BERCES,D.M.WHITFIELD
Literature Reference Citation J.ORG.CHEM.,64,9030(1999)
Literature Reference DOI 10.1021/jo990712b
Molecular Weight 270.328 g/mol
Sample ID 59919
Solvent CDCl3