| SpectraBase Spectrum ID |
90NBLf0uR9X |
| Name |
tert-Butyl 3-(3-(4-bromphenyl)-1-phenylprop-2-ynylidene)-2-oxoindolin-1-carboxylate |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
499.078306569 u |
| Formula |
C28H22BrNO3 |
| InChI |
InChI=1S/C28H22BrNO3/c1-28(2,3)33-27(32)30-24-12-8-7-11-23(24)25(26(30)31)22(20-9-5-4-6-10-20)18-15-19-13-16-21(29)17-14-19/h4-14,16-17H,1-3H3 |
| InChIKey |
WAYALABZQQJOPS-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201802237 |
| Molecular Weight |
500.392 g/mol |
| SMILES |
C1(N(C=2C=CC=CC2C1=C(C#CC=1C=CC(=CC1)Br)C=1C=CC=CC1)C(=O)OC(C)(C)C)=O |
| SPLASH |
splash10-03dj-0039100000-9a03fb5920b53ebeff72 |
| Sample Comments |
E/Z = 40:60 |
| Source of Spectrum |
QE-24-SM12-5l (DOI: 10.1002/chem.201802237) |
| Wiley ID |
1901713 |
