| SpectraBase Spectrum ID |
8z0gC1rWn16 |
| Name |
((4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-diyl)bis(bis(3-(trifluoromethyl)phenyl)methanol) |
| Appearance |
Faint yellow powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H26F12O4 |
| InChI |
InChI=1S/C35H26F12O4/c1-29(2)50-27(30(48,19-7-3-11-23(15-19)32(36,37)38)20-8-4-12-24(16-20)33(39,40)41)28(51-29)31(49,21-9-5-13-25(17-21)34(42,43)44)22-10-6-14-26(18-22)35(45,46)47/h3-18,27-28,48-49H,1-2H3/t27-,28?/m1/s1 |
| InChIKey |
AQIMMEXZCAQSID-QXPUDEPPSA-N |
| Instrument Name |
SUPELCO .beta.-DEX 120 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.7.166 |
| Molecular Weight |
738.570 g/mol |
| Optical Rotation |
[a]D = ???35.1 (c = 1.26, MeOH) |
| SMILES |
OC(C1OC(O[C@]1(C(c1cccc(c1)C(F)(F)F)(O)c1cccc(c1)C(F)(F)F)[H])(C)C)(c1cccc(c1)C(F)(F)F)c1cc(ccc1)C(F)(F)F |
| SPLASH |
splash10-00xr-0709000000-52502eb00bee6cc9d395 |
| Source of Spectrum |
BJO-7-SM10-T6 |
| Thin-Layer Chromatography |
Rf = 0.1 (t-BuOMe/hexane, 1:10) |
| Wiley ID |
1867136 |
