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1-(Benzylsulfanyl)-2,2-bis[diphenylphosphanylmethyl] propane

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1-(Benzylsulfanyl)-2,2-bis[diphenylphosphanylmethyl] propane
SpectraBase Compound ID IcQEigH23nr
InChI InChI=1S/C36H36P2S/c1-36(30-39-27-31-17-7-2-8-18-31,28-37(32-19-9-3-10-20-32)33-21-11-4-12-22-33)29-38(34-23-13-5-14-24-34)35-25-15-6-16-26-35/h2-26H,27-30H2,1H3
InChIKey QJNHRCRDVYFIHU-UHFFFAOYSA-N
Mol Weight 562.7 g/mol
Molecular Formula C36H36P2S
Exact Mass 562.201296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LxzihVNAp0J
Name 1-(Benzylsulfanyl)-2,2-bis[diphenylphosphanylmethyl] propane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 562.201296329 u
Formula C36H36P2S
InChI InChI=1S/C36H36P2S/c1-36(30-39-27-31-17-7-2-8-18-31,28-37(32-19-9-3-10-20-32)33-21-11-4-12-22-33)29-38(34-23-13-5-14-24-34)35-25-15-6-16-26-35/h2-26H,27-30H2,1H3
InChIKey QJNHRCRDVYFIHU-UHFFFAOYSA-N
Molecular Weight 562.692 g/mol
SMILES C(P(C1=CC=CC=C1)C1=CC=CC=C1)C(CP(C=1C=CC=CC1)C=1C=CC=CC1)(CSCC=1C=CC=CC1)C