| SpectraBase Spectrum ID |
91XCqpJa1CT |
| Name |
5-Bromo-2-(octan-2-yl)-1-(pyridin-2-yl)-1H-indole |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25BrN2 |
| InChI |
InChI=1S/C21H25BrN2/c1-3-4-5-6-9-16(2)20-15-17-14-18(22)11-12-19(17)24(20)21-10-7-8-13-23-21/h7-8,10-16H,3-6,9H2,1-2H3 |
| InChIKey |
PVYUQMIUJQJSLO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201704196 |
| Molecular Weight |
385.349 g/mol |
| Reported Formula |
C21H25(79)BrN2 |
| SMILES |
C1(Br)=CC2=C(C=C1)N(C(=C2)C(C)CCCCCC)C1=NC=CC=C1 |
| SPLASH |
splash10-00kr-0092000000-430c9ac53f323dde9954 |
| Source of Spectrum |
ACI-56-SM22-4da (DOI: 10.1002/anie.201704196) |
| Wiley ID |
1896275 |
