| SpectraBase Spectrum ID |
JJCOqaKSMBU |
| Name |
3-iso-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/c1-9(2)8-12-10(3)14-13-7-5-4-6-11(12)13/h4-7,9,14H,8H2,1-3H3 |
| InChIKey |
ZLKDRCRAOWCIRM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
187.286 g/mol |
| Nominal Mass |
187 u |
| Quality |
987 |
| Retention Index |
1666 |
| SMILES |
C=12C(=C(NC2=CC=CC1)C)CC(C)C |
| SPLASH |
splash10-0006-3900000000-8a5dd8c313fe1488ce8c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Indole,3-iso-butyl-2-methyl
3-(2-Methylpropyl)-2-methylindole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015328 |
