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2-(2-cyclohexyl-2-phenyl-ethyl)malonic acid diethyl ester
SpectraBase Compound ID AOAVl6EcZYu
InChI InChI=1S/C21H30O4/c1-3-24-20(22)19(21(23)25-4-2)15-18(16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5,7-8,11-12,17-19H,3-4,6,9-10,13-15H2,1-2H3
InChIKey UZIZGELFEYIOIC-UHFFFAOYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zNx9WyehGH
Name 2-(2-cyclohexyl-2-phenyl-ethyl)malonic acid diethyl ester
Alternate Name(s) 2-(2-cyclohexyl-2-phenylethyl)propanedioic acid diethyl ester Diethyl 2-(2-cyclohexyl-2-phenyl-ethyl)propanedioate
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Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-3-24-20(22)19(21(23)25-4-2)15-18(16-11-7-5-8-12-16)17-13-9-6-10-14-17/h5,7-8,11-12,17-19H,3-4,6,9-10,13-15H2,1-2H3
InChIKey UZIZGELFEYIOIC-UHFFFAOYSA-N
Molecular Weight 346.467 g/mol
SMILES C(C(C(=O)OCC)CC(c1ccccc1)C1CCCCC1)(=O)OCC
SPLASH splash10-03di-3900000000-3f4cb36e7d3cc6ac3fa1
Source of Spectrum E1-37-3806-49
Wiley ID 1575420