| SpectraBase Spectrum ID |
DmbGlrxbgNU |
| Name |
3-Benzoylindole |
| CAS Registry Number |
15224-25-6 |
| Classification |
Pharmaceutical drug precursor |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
221.084063977 u |
| Formula |
C15H11NO |
| InChI |
InChI=1S/C15H11NO/c17-15(11-6-2-1-3-7-11)13-10-16-14-9-5-4-8-12(13)14/h1-10,16H |
| InChIKey |
ADHQLIGSIQGNBW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
221.259 g/mol |
| Nominal Mass |
221 u |
| Quality |
946 |
| Retention Index |
2490 |
| SMILES |
C=1(C=2C(NC1)=CC=CC2)C(C=1C=CC=CC1)=O |
| SPLASH |
splash10-006x-3930000000-de60d39e06f837fbd653 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(1H-Indol-3-yl)phenyl-methanone
1H-Indol-3-yl(phenyl)methanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015010 |
