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(S)-2-(2-Methoxypropyl-2-oxy)-5-trimethylsilyl-4-pentynyl toslate
SpectraBase Compound ID 1Q1oyd3U57U
InChI InChI=1S/C19H30O5SSi/c1-16-10-12-18(13-11-16)25(20,21)23-15-17(24-19(2,3)22-4)9-8-14-26(5,6)7/h10-13,17H,9,15H2,1-7H3/t17-/m0/s1
InChIKey CCAFDPPHNKQJPL-KRWDZBQOSA-N
Mol Weight 398.59 g/mol
Molecular Formula C19H30O5SSi
Exact Mass 398.158322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3CnRqfpHVhi
Name (S)-2-(2-Methoxypropyl-2-oxy)-5-trimethylsilyl-4-pentynyl toslate
Comments Computed using HOSE algorithm
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Exact Mass 398.158321770 u
Formula C19H30O5SSi
InChI InChI=1S/C19H30O5SSi/c1-16-10-12-18(13-11-16)25(20,21)23-15-17(24-19(2,3)22-4)9-8-14-26(5,6)7/h10-13,17H,9,15H2,1-7H3/t17-/m0/s1
InChIKey CCAFDPPHNKQJPL-KRWDZBQOSA-N
Molecular Weight 398.589 g/mol
SMILES C(OS(C=1C=CC(=CC1)C)(=O)=O)[C@@](OC(OC)(C)C)(CC#C[Si](C)(C)C)[H]