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5-[Tert-butyl(diphenyl)silyl]oxy-4-methyl-1-cyclohex-3-enecarboxylic acid methyl ester
SpectraBase Compound ID 7JNiWud4HSg
InChI InChI=1S/C25H32O3Si/c1-19-16-17-20(24(26)27-5)18-23(19)28-29(25(2,3)4,21-12-8-6-9-13-21)22-14-10-7-11-15-22/h6-16,20,23H,17-18H2,1-5H3
InChIKey IJHLVBQOEKJEON-UHFFFAOYSA-N
Mol Weight 408.6 g/mol
Molecular Formula C25H32O3Si
Exact Mass 408.212071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6aQPfrXA799
Name 5-[Tert-butyl(diphenyl)silyl]oxy-4-methyl-1-cyclohex-3-enecarboxylic acid methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 408.212071422 u
Formula C25H32O3Si
InChI InChI=1S/C25H32O3Si/c1-19-16-17-20(24(26)27-5)18-23(19)28-29(25(2,3)4,21-12-8-6-9-13-21)22-14-10-7-11-15-22/h6-16,20,23H,17-18H2,1-5H3
InChIKey IJHLVBQOEKJEON-UHFFFAOYSA-N
Molecular Weight 408.613 g/mol
SMILES C1(O[Si](C(C)(C)C)(C=2C=CC=CC2)C2=CC=CC=C2)C(=CCC(C(=O)OC)C1)C