| SpectraBase Spectrum ID |
DJpbcVQETLd |
| Name |
(-)-{2-[(4'S)-(4'-tert-butyloxazolin-2'-yl)]-2-methylethyl}-[(R)-[3,3'-bis(4-biphenylyl)binaphthyl-2,2'-diyl]phosphite |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
803.316445959 u |
| Formula |
C54H46NO4P |
| InChI |
InChI=1S/C54H46NO4P/c1-53(2,3)47-34-56-52(55-47)54(4,5)59-60-57-50-45(39-28-24-37(25-29-39)35-16-8-6-9-17-35)32-41-20-12-14-22-43(41)48(50)49-44-23-15-13-21-42(44)33-46(51(49)58-60)40-30-26-38(27-31-40)36-18-10-7-11-19-36/h6-33,47H,34H2,1-5H3/t47-/m1/s1 |
| InChIKey |
VTCDVULBJKWMNN-QZNUWAOFSA-N |
| Molecular Weight |
803.939 g/mol |
| SMILES |
C1=2OP(OC=3C(C2C2=CC=CC=C2C=C1C=1C=CC(C=2C=CC=CC2)=CC1)=C1C(=CC3C2=CC=C(C=C2)C2=CC=CC=C2)C=CC=C1)OC(C1=N[C@@](C(C)(C)C)(CO1)[H])(C)C |
![(-)-{2-[(4'S)-(4'-tert-butyloxazolin-2'-yl)]-2-methylethyl}-[(R)-[3,3'-bis(4-biphenylyl)binaphthyl-2,2'-diyl]phosphite](/api/spectrum/DJpbcVQETLd/structure.png?h=300&w=458 "(-)-{2-[(4'S)-(4'-tert-butyloxazolin-2'-yl)]-2-methylethyl}-[(R)-[3,3'-bis(4-biphenylyl)binaphthyl-2,2'-diyl]phosphite")
