| SpectraBase Spectrum ID |
LhIKdtrQKgp |
| Name |
(3S,1'R)-6-Chloro-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 |
342.149891068 u |
| Formula |
C20H23ClN2O |
| InChI |
InChI=1S/C20H23ClN2O/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-/m0/s1 |
| InChIKey |
MVJKSOIYKPRGGF-ICSRJNTNSA-N |
| Instrument Name |
Thermo Scientific DFS-HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201600600 |
| Molecular Weight |
342.870 g/mol |
| Quality |
129 |
| Reported Formula |
C20H23(37)ClNO2 |
| SMILES |
N1C([C@](C2=C1C=C(C=C2)Cl)([C@@](CC)(CN(C1=CC=CC=C1)C)C)[H])=O |
| SPLASH |
splash10-0ab9-2940000000-3c62b66b45dbe38969a3 |
| Sample Comments |
72% ee |
| Source of Spectrum |
QE-22-SM46-epi-8c (DOI: 10.1002/chem.201600600) |
| Thin-Layer Chromatography |
0.19 (n-pentane/EtOAc, 5:1) |
| Wiley ID |
1904858 |
![(3S,1'R)-6-Chloro-3-{2'-methyl-1'-[methyl(phenyl)amino]butan-2-yl}indolin-2-one](/api/spectrum/LhIKdtrQKgp/structure.png?h=300&w=458 "(3S,1'R)-6-Chloro-3-{2'-methyl-1'-[methyl(phenyl)amino]butan-2-yl}indolin-2-one")
