| SpectraBase Spectrum ID |
JGa2wBACfnU |
| Name |
3-Butyl-2-methylindole |
| Classification |
Pharmaceutical drug precursor |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
187.136099551 u |
| Formula |
C13H17N |
| InChI |
InChI=1S/C13H17N/c1-3-4-7-11-10(2)14-13-9-6-5-8-12(11)13/h5-6,8-9,14H,3-4,7H2,1-2H3 |
| InChIKey |
ZEGLHVKVGBJOME-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
187.286 g/mol |
| Nominal Mass |
187 u |
| Quality |
992 |
| Retention Index |
1714 |
| SMILES |
C=12C(=C(NC2=CC=CC1)C)CCCC |
| SPLASH |
splash10-0006-0900000000-4f5910d5ab273d8ef911 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Indole,3-butyl-2-methyl
3-Butyl-2-methyl-1H-indole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015275 |
