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(R,S)-di(sec-Butoxythiophosphoryl)(diethoxythiophosphoryl)trisulphide

View entire compound with spectra: 2 NMR

(R,S)-di(sec-Butoxythiophosphoryl)(diethoxythiophosphoryl)trisulphide
SpectraBase Compound ID G2wumETEB9Z
InChI InChI=1S/C12H28O4P2S5/c1-7-11(5)15-18(20,16-12(6)8-2)22-23-21-17(19,13-9-3)14-10-4/h11-12H,7-10H2,1-6H3/t11-,12+,18-
InChIKey WWBGPIRJWHMPCQ-KSPBDQMDSA-N
Mol Weight 458.6 g/mol
Molecular Formula C12H28O4P2S5
Exact Mass 458.006639 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Vg63YuPd6d
Name (R,S)-di(sec-Butoxythiophosphoryl)(diethoxythiophosphoryl)trisulphide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.006639244 u
Formula C12H28O4P2S5
InChI InChI=1S/C12H28O4P2S5/c1-7-11(5)15-18(20,16-12(6)8-2)22-23-21-17(19,13-9-3)14-10-4/h11-12H,7-10H2,1-6H3/t11-,12+,18-
InChIKey WWBGPIRJWHMPCQ-KSPBDQMDSA-N
Molecular Weight 458.600 g/mol
SMILES [C@]([H])(C)(CC)O[P@](SSSP(=S)(OCC)OCC)(O[C@]([H])(C)CC)=S