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2-[(S)-2-Diphenylphosphinoyl-1-hydroxyethyl]dithiolane
SpectraBase Compound ID KU3m14KEG1W
InChI InChI=1S/C17H19O2PS2/c18-16(17-21-11-12-22-17)13-20(19,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m0/s1
InChIKey VSALVPNKVCSHJV-INIZCTEOSA-N
Mol Weight 350.43 g/mol
Molecular Formula C17H19O2PS2
Exact Mass 350.056409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GinNP7DzYeb
Name 2-[(S)-2-Diphenylphosphinoyl-1-hydroxyethyl]dithiolane
Comments Computed using HOSE algorithm
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Exact Mass 350.056409196 u
Formula C17H19O2PS2
InChI InChI=1S/C17H19O2PS2/c18-16(17-21-11-12-22-17)13-20(19,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-/m0/s1
InChIKey VSALVPNKVCSHJV-INIZCTEOSA-N
Molecular Weight 350.431 g/mol
SMILES C(P(=O)(C1=CC=CC=C1)C1=CC=CC=C1)[C@@](C1SCCS1)(O)[H]