| SpectraBase Spectrum ID |
dha0m8qzIf |
| Name |
(3R,1'R)-6-Bromo-3-{2'-methyl-1'-[methyl(phenyl)amino]butan-2'-yl}indolin-2-one |
| Appearance |
White foam |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.099376368 u |
| Formula |
C20H23BrN2O |
| InChI |
InChI=1S/C20H23BrN2O/c1-4-20(2,13-23(3)15-8-6-5-7-9-15)18-16-11-10-14(21)12-17(16)22-19(18)24/h5-12,18H,4,13H2,1-3H3,(H,22,24)/t18-,20+/m1/s1 |
| InChIKey |
RTVNQFOPIARSSJ-QUCCMNQESA-N |
| Instrument Name |
Thermo Scientific DFS-HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201600600 |
| Molecular Weight |
387.321 g/mol |
| Quality |
101 |
| Reported Formula |
C19(13)CH23N2O(81)Br |
| SMILES |
N1C([C@@](C2=C1C=C(C=C2)Br)([C@@](CC)(CN(C1=CC=CC=C1)C)C)[H])=O |
| SPLASH |
splash10-00di-0920000000-519a60301458f5a6c231 |
| Sample Comments |
69% ee |
| Source of Spectrum |
QE-22-SM51-rac-8f (DOI: 10.1002/chem.201600600) |
| Thin-Layer Chromatography |
0.43 (n-pentane/EtOAc, 3:1) |
| Wiley ID |
1904868 |
![(3R,1'R)-6-Bromo-3-{2'-methyl-1'-[methyl(phenyl)amino]butan-2'-yl}indolin-2-one](/api/spectrum/dha0m8qzIf/structure.png?h=300&w=458 "(3R,1'R)-6-Bromo-3-{2'-methyl-1'-[methyl(phenyl)amino]butan-2'-yl}indolin-2-one")
