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3-(Octylsulfanyl)propanoic acid, trimethylsilyl ester
SpectraBase Compound ID DlVgm8VUhOg
InChI InChI=1S/C14H30O2SSi/c1-5-6-7-8-9-10-12-17-13-11-14(15)16-18(2,3)4/h5-13H2,1-4H3
InChIKey GMYFCJWPWRTNCU-UHFFFAOYSA-N
Mol Weight 290.54 g/mol
Molecular Formula C14H30O2SSi
Exact Mass 290.173578 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3SUWg7UscvO
Name 3-(Octylsulfanyl)propanoic acid, trimethylsilyl ester
Comments Computed using HOSE algorithm
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Exact Mass 290.173577913 u
Formula C14H30O2SSi
InChI InChI=1S/C14H30O2SSi/c1-5-6-7-8-9-10-12-17-13-11-14(15)16-18(2,3)4/h5-13H2,1-4H3
InChIKey GMYFCJWPWRTNCU-UHFFFAOYSA-N
SMILES C(SCCC(=O)O[Si](C)(C)C)CCCCCCC