SpectraBase Spectrum ID |
4eMS99gqR2m |
Name |
Tert-butyl [2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]carbamate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
352.078640922 u |
Formula |
C16H21BrN2O2 |
InChI |
InChI=1S/C16H21BrN2O2/c1-10-12(7-8-18-15(20)21-16(2,3)4)13-9-11(17)5-6-14(13)19-10/h5-6,9,19H,7-8H2,1-4H3,(H,18,20) |
InChIKey |
KLPRZWCOUSDNIR-UHFFFAOYSA-N |
Molecular Weight |
353.260 g/mol |
SMILES |
C1=C(C=C2C(=C1)NC(=C2CCNC(=O)OC(C)(C)C)C)Br |