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(S)-2-Amino-2'-[bis-(3,5-difluorophenyl)-phosphinoyl]-1,1'-binaphthyl

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(S)-2-Amino-2'-[bis-(3,5-difluorophenyl)-phosphinoyl]-1,1'-binaphthyl
SpectraBase Compound ID 1MS1RbuFLgD
InChI InChI=1S/C32H20F4NOP/c33-21-13-22(34)16-25(15-21)39(38,26-17-23(35)14-24(36)18-26)30-12-10-20-6-2-4-8-28(20)32(30)31-27-7-3-1-5-19(27)9-11-29(31)37/h1-18H,37H2
InChIKey AIQMPUWUSIPAFJ-UHFFFAOYSA-N
Mol Weight 541.5 g/mol
Molecular Formula C32H20F4NOP
Exact Mass 541.121864 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7nfIPwW1r3Q
Name (S)-2-Amino-2'-[bis-(3,5-difluorophenyl)-phosphinoyl]-1,1'-binaphthyl
Comments Computed using HOSE algorithm
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Exact Mass 541.121863917 u
Formula C32H20F4NOP
InChI InChI=1S/C32H20F4NOP/c33-21-13-22(34)16-25(15-21)39(38,26-17-23(35)14-24(36)18-26)30-12-10-20-6-2-4-8-28(20)32(30)31-27-7-3-1-5-19(27)9-11-29(31)37/h1-18H,37H2
InChIKey AIQMPUWUSIPAFJ-UHFFFAOYSA-N
Molecular Weight 541.485 g/mol
SMILES C1(N)=C(C2=C(C=CC=3C=CC=CC23)P(=O)(C2=CC(F)=CC(F)=C2)C2=CC(F)=CC(F)=C2)C2=C(C=C1)C=CC=C2