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t-Butyl 2-(cyclohexylcarbonyl)-5-phenylpent-2-enoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

t-Butyl 2-(cyclohexylcarbonyl)-5-phenylpent-2-enoate
SpectraBase Compound ID 3ctgXkufe0D
InChI InChI=1S/C22H30O3/c1-22(2,3)25-21(24)19(20(23)18-14-8-5-9-15-18)16-10-13-17-11-6-4-7-12-17/h4,6-7,11-12,16,18H,5,8-10,13-15H2,1-3H3/b19-16+
InChIKey YYJCKYWUVIRVIW-KNTRCKAVSA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FTZoaTbu326
Name T-Butyl 2-(cyclohexylcarbonyl)-5-phenylpent-2-enoate
Comments Computed using HOSE algorithm
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Exact Mass 342.219494823 u
Formula C22H30O3
InChI InChI=1S/C22H30O3/c1-22(2,3)25-21(24)19(20(23)18-14-8-5-9-15-18)16-10-13-17-11-6-4-7-12-17/h4,6-7,11-12,16,18H,5,8-10,13-15H2,1-3H3/b19-16+
InChIKey YYJCKYWUVIRVIW-KNTRCKAVSA-N
Molecular Weight 342.479 g/mol
SMILES C(\C(=C\CCC=1C=CC=CC1)C(=O)C1CCCCC1)(=O)OC(C)(C)C