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3-(Diphenylphosphoryl)propanoic acid, tms derivative
SpectraBase Compound ID unEXPDs8Bu
InChI InChI=1S/C18H23O3PSi/c1-23(2,3)21-18(19)14-15-22(20,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKey MDRNHBULPJDRLN-UHFFFAOYSA-N
Mol Weight 346.44 g/mol
Molecular Formula C18H23O3PSi
Exact Mass 346.115408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ak3yTY8XAR
Name 3-(Diphenylphosphoryl)propanoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 346.115408131 u
Formula C18H23O3PSi
InChI InChI=1S/C18H23O3PSi/c1-23(2,3)21-18(19)14-15-22(20,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKey MDRNHBULPJDRLN-UHFFFAOYSA-N
Molecular Weight 346.438 g/mol
SMILES C(P(=O)(C1=CC=CC=C1)C1=CC=CC=C1)CC(O[Si](C)(C)C)=O