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(2R,3S,4S,5R)-2,5-Bis(1-pyrrolidinyl)-1,6-diphenyl-3,4-bis(diphenylphosphinyl)hexane

View entire compound with spectra: 1 MS (GC)

(2R,3S,4S,5R)-2,5-Bis(1-pyrrolidinyl)-1,6-diphenyl-3,4-bis(diphenylphosphinyl)hexane
SpectraBase Compound ID GlRxb0Hf3Nd
InChI InChI=1S/C50H54N2O2P2/c53-55(43-27-11-3-12-28-43,44-29-13-4-14-30-44)49(47(51-35-19-20-36-51)39-41-23-7-1-8-24-41)50(48(52-37-21-22-38-52)40-42-25-9-2-10-26-42)56(54,45-31-15-5-16-32-45)46-33-17-6-18-34-46/h1-18,23-34,47-50H,19-22,35-40H2/t47-,48-,49+,50+/m1/s1
InChIKey XHAFLTYSBMQNFU-NAZFTMCISA-N
Mol Weight 776.9 g/mol
Molecular Formula C50H54N2O2P2
Exact Mass 776.366053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTuDXQkjmMs
Name (2R,3S,4S,5R)-2,5-Bis(1-pyrrolidinyl)-1,6-diphenyl-3,4-bis(diphenylphosphinyl)hexane
Alternate Name(s) 1-[(1R,2S,3S,4R)-1-benzyl-2,3-bis(diphenylphosphoryl)-5-phenyl-4-(1-pyrrolidinyl)pentyl]pyrrolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C50H54N2O2P2
InChI InChI=1S/C50H54N2O2P2/c53-55(43-27-11-3-12-28-43,44-29-13-4-14-30-44)49(47(51-35-19-20-36-51)39-41-23-7-1-8-24-41)50(48(52-37-21-22-38-52)40-42-25-9-2-10-26-42)56(54,45-31-15-5-16-32-45)46-33-17-6-18-34-46/h1-18,23-34,47-50H,19-22,35-40H2/t47-,48-,49+,50+/m1/s1
InChIKey XHAFLTYSBMQNFU-NAZFTMCISA-N
Molecular Weight 776.942 g/mol
SMILES [C@@]([C@@](P(=O)(c1ccccc1)c1ccccc1)([C@](N1CCCC1)(Cc1ccccc1)[H])[H])(P(=O)(c1ccccc1)c1ccccc1)([C@](N1CCCC1)(Cc1ccccc1)[H])[H]
SPLASH splash10-00di-0962200000-1922f17258f1750ff6c5
Source of Spectrum QC-11-3128-5
Wiley ID 859992