| SpectraBase Spectrum ID |
JHJGy3UdAIq |
| Name |
1-(3-Methylphenyl)hexan-1-one |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
190.135765199 u |
| Formula |
C13H18O |
| InChI |
InChI=1S/C13H18O/c1-3-4-5-9-13(14)12-8-6-7-11(2)10-12/h6-8,10H,3-5,9H2,1-2H3 |
| InChIKey |
TWNPDBWYWNMKDY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
190.286 g/mol |
| Nominal Mass |
190 u |
| Quality |
983 |
| Retention Index |
1382 |
| SMILES |
C1(C(CCCCC)=O)=CC(=CC=C1)C |
| SPLASH |
splash10-014l-5900000000-68d1589c476efbd5ccd9 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(3-methylphenyl)hexan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002341 |
