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(-)-{1-[(4'S)-(4'-tert-Butyloxazolin-2'-yl)]-1-methylethyl}-[(R)-(3,3'-diphenyl)binaphthyl-2,2'-diyl]phosphite
SpectraBase Compound ID HmCKvm05hmt
InChI InChI=1S/C42H38NO4P/c1-41(2,3)35-26-44-40(43-35)42(4,5)47-48-45-38-33(27-16-8-6-9-17-27)24-29-20-12-14-22-31(29)36(38)37-32-23-15-13-21-30(32)25-34(39(37)46-48)28-18-10-7-11-19-28/h6-25,35H,26H2,1-5H3/t35-/m1/s1
InChIKey NAJPDTOEOZYBNX-PGUFJCEWSA-N
Mol Weight 651.7 g/mol
Molecular Formula C42H38NO4P
Exact Mass 651.253846 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQFpEcAx0jv
Name (-)-{1-[(4'S)-(4'-tert-Butyloxazolin-2'-yl)]-1-methylethyl}-[(R)-(3,3'-diphenyl)binaphthyl-2,2'-diyl]phosphite
Alternate Name(s) (-)-{2-[(4'S)-(4'-tert-Butyloxazolin-2'-yl)]-2-methylethyl}-[(R)-(3,3'-diphenyl)binaphthyl-2,2'-diyl]phosphite (4S)-4-tert-butyl-2-{1-[(4,15-diphenyldinaphtho[2,1-d:1,2-f][1,3,2]dioxaphosphepin-2-yl)oxy]-1-methylethyl}-4,5-dihydro-1,3-oxazole
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Formula C42H38NO4P
InChI InChI=1S/C42H38NO4P/c1-41(2,3)35-26-44-40(43-35)42(4,5)47-48-45-38-33(27-16-8-6-9-17-27)24-29-20-12-14-22-31(29)36(38)37-32-23-15-13-21-30(32)25-34(39(37)46-48)28-18-10-7-11-19-28/h6-25,35H,26H2,1-5H3/t35-/m1/s1
InChIKey NAJPDTOEOZYBNX-PGUFJCEWSA-N
Molecular Weight 651.743 g/mol
SMILES c12OP(Oc3c(-c2c2ccccc2cc1-c1ccccc1)c1ccccc1cc3-c1ccccc1)OC(C1=N[C@@](C(C)(C)C)(CO1)[H])(C)C
SPLASH splash10-0uxr-0400719000-7e7e45818460e3fce65b
Source of Spectrum F-56-2884-6
Wiley ID 856835