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trans-5-tert-Butyl-2-(diphenylphosphinoyl)-1,3-dithiane
SpectraBase Compound ID ELXuweS6X1C
InChI InChI=1S/C20H25OPS2/c1-20(2,3)16-14-23-19(24-15-16)22(21,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,19H,14-15H2,1-3H3/t16-,19-
InChIKey XQFNHLYSBAZNOD-RUCARUNLSA-N
Mol Weight 376.51 g/mol
Molecular Formula C20H25OPS2
Exact Mass 376.108445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L6k2UqTxkY2
Name trans-5-tert-Butyl-2-(diphenylphosphinoyl)-1,3-dithiane
Alternate Name(s) (5-tert-butyl-1,3-dithian-2-yl)(diphenyl)phosphine oxide
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Formula C20H25OPS2
InChI InChI=1S/C20H25OPS2/c1-20(2,3)16-14-23-19(24-15-16)22(21,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,19H,14-15H2,1-3H3/t16-,19-
InChIKey XQFNHLYSBAZNOD-RUCARUNLSA-N
Molecular Weight 376.513 g/mol
SMILES [C@]1(P(=O)(c2ccccc2)c2ccccc2)(SC[C@](CS1)(C(C)(C)C)[H])[H]
SPLASH splash10-004i-1900000000-db05ae7a390bebaae0d5
Source of Spectrum J-59-1689-9
Wiley ID 1357689