| SpectraBase Spectrum ID |
JG0OHBwWJ4y |
| Name |
3-Butyrylindole |
| CAS Registry Number |
22582-67-8 |
| Classification |
Pharmaceutical drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
187.099714042 u |
| Formula |
C12H13NO |
| InChI |
InChI=1S/C12H13NO/c1-2-5-12(14)10-8-13-11-7-4-3-6-9(10)11/h3-4,6-8,13H,2,5H2,1H3 |
| InChIKey |
CPSCIKJSJRJTMF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
187.242 g/mol |
| Nominal Mass |
187 u |
| Quality |
979 |
| Retention Index |
2023 |
| SMILES |
C=12C(=CNC2=CC=CC1)C(CCC)=O |
| SPLASH |
splash10-0006-1900000000-91ef749c505eb9453b1c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Butanone,1-(1H-indol-3-yl)
1-(1H-Indol-3-yl)-1-butanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015013 |
