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3-Phenylsulfanyl-2-[2'-(5,5-dimethyl-1,3,2-dioxaphosphorinanyl)]thiolane 1-oxide
SpectraBase Compound ID 9QsVjLuxnpb
InChI InChI=1S/C15H21O4PS2/c1-15(2)10-18-20(16,19-11-15)14-13(8-9-22(14)17)21-12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3/q-1/t13-,14-/m1/s1
InChIKey HJQMHWGJBBBQTK-ZIAGYGMSSA-N
Mol Weight 361.43 g/mol
Molecular Formula C15H22O4PS2
Exact Mass 361.069714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63RbOG9titN
Name 3-Phenylsulfanyl-2-[2'-(5,5-dimethyl-1,3,2-dioxaphosphorinanyl)]thiolane 1-oxide
Comments Less than 3 mono-isotopic peaks
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Formula C15H21O4PS2
InChI InChI=1S/C15H21O4PS2/c1-15(2)10-18-20(16,19-11-15)14-13(8-9-22(14)17)21-12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3/q-1/t13-,14-/m1/s1
InChIKey HJQMHWGJBBBQTK-ZIAGYGMSSA-N
Molecular Weight 361.431 g/mol
SMILES S1(CC[C@]([C@@]1(P1(OCC(C)(C)CO1)=O)[H])(Sc1ccccc1)[H])[O-]
SPLASH splash10-03di-0901000000-05230580485c1e57bf5e
Source of Spectrum QC-20-296-2
Wiley ID 1688001