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(S)-2-Benzyloxy)-5-trimethylsilyl-4-pentynyl toslate
SpectraBase Compound ID 6SMIRjKsOF0
InChI InChI=1S/C22H28O4SSi/c1-19-12-14-22(15-13-19)27(23,24)26-18-21(11-8-16-28(2,3)4)25-17-20-9-6-5-7-10-20/h5-7,9-10,12-15,21H,11,17-18H2,1-4H3/t21-/m0/s1
InChIKey KPACWGWTEMAJBE-NRFANRHFSA-N
Mol Weight 416.61 g/mol
Molecular Formula C22H28O4SSi
Exact Mass 416.147757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4usWTGIuy23
Name (S)-2-Benzyloxy)-5-trimethylsilyl-4-pentynyl toslate
Comments Computed using HOSE algorithm
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Exact Mass 416.147757087 u
Formula C22H28O4SSi
InChI InChI=1S/C22H28O4SSi/c1-19-12-14-22(15-13-19)27(23,24)26-18-21(11-8-16-28(2,3)4)25-17-20-9-6-5-7-10-20/h5-7,9-10,12-15,21H,11,17-18H2,1-4H3/t21-/m0/s1
InChIKey KPACWGWTEMAJBE-NRFANRHFSA-N
Molecular Weight 416.607 g/mol
SMILES C(OS(C1=CC=C(C=C1)C)(=O)=O)[C@@](OCC1=CC=CC=C1)(CC#C[Si](C)(C)C)[H]