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(S)-4-Tert-butyl-2-((R)-2'-(bis(3,5-dimethylphenyl)phosphino)-1,1'-binaphthyl-2-yl)-4,5-dihydrooxazole

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(S)-4-Tert-butyl-2-((R)-2'-(bis(3,5-dimethylphenyl)phosphino)-1,1'-binaphthyl-2-yl)-4,5-dihydrooxazole
SpectraBase Compound ID 3IgYe5y0XIF
InChI InChI=1S/C43H42NOP/c1-27-20-28(2)23-33(22-27)46(34-24-29(3)21-30(4)25-34)38-19-17-32-13-9-11-15-36(32)41(38)40-35-14-10-8-12-31(35)16-18-37(40)42-44-39(26-45-42)43(5,6)7/h8-25,39H,26H2,1-7H3/t39-/m0/s1
InChIKey AJKUNTMTOVYUDV-KDXMTYKHSA-N
Mol Weight 619.8 g/mol
Molecular Formula C43H42NOP
Exact Mass 619.300402 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfccE5FUQhr
Name (S)-4-Tert-butyl-2-((R)-2'-(bis(3,5-dimethylphenyl)phosphino)-1,1'-binaphthyl-2-yl)-4,5-dihydrooxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 619.300401973 u
Formula C43H42NOP
InChI InChI=1S/C43H42NOP/c1-27-20-28(2)23-33(22-27)46(34-24-29(3)21-30(4)25-34)38-19-17-32-13-9-11-15-36(32)41(38)40-35-14-10-8-12-31(35)16-18-37(40)42-44-39(26-45-42)43(5,6)7/h8-25,39H,26H2,1-7H3/t39-/m0/s1
InChIKey AJKUNTMTOVYUDV-KDXMTYKHSA-N
Molecular Weight 619.789 g/mol
SMILES C=1(C(P(C=2C=C(C=C(C2)C)C)C2=CC(C)=CC(=C2)C)=CC=C2C1C=CC=C2)C=1C(C2=N[C@](C(C)(C)C)(CO2)[H])=CC=C2C1C=CC=C2