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2-[4-(1-Methyl-1-phenylethyl)phenoxy]propanoic acid, o-tms

View entire compound with spectra: 1 NMR

2-[4-(1-Methyl-1-phenylethyl)phenoxy]propanoic acid, o-tms
SpectraBase Compound ID 2IjABAYXtpq
InChI InChI=1S/C21H28O3Si/c1-16(20(22)24-25(4,5)6)23-19-14-12-18(13-15-19)21(2,3)17-10-8-7-9-11-17/h7-16H,1-6H3
InChIKey YGJPZCRVBQXRLN-UHFFFAOYSA-N
Mol Weight 356.54 g/mol
Molecular Formula C21H28O3Si
Exact Mass 356.180771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HpcEplmA7w
Name 2-[4-(1-Methyl-1-phenylethyl)phenoxy]propanoic acid, o-tms
Comments Computed using HOSE algorithm
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Exact Mass 356.180771294 u
Formula C21H28O3Si
InChI InChI=1S/C21H28O3Si/c1-16(20(22)24-25(4,5)6)23-19-14-12-18(13-15-19)21(2,3)17-10-8-7-9-11-17/h7-16H,1-6H3
InChIKey YGJPZCRVBQXRLN-UHFFFAOYSA-N
Molecular Weight 356.537 g/mol
SMILES C(C)(C)(C1=CC=C(C=C1)OC(C(O[Si](C)(C)C)=O)C)C1=CC=CC=C1