| SpectraBase Spectrum ID |
8kG2J8i1Afo |
| Name |
1-(4-Propylphenyl)propanone |
| 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 |
176.120115134 u |
| Formula |
C12H16O |
| InChI |
InChI=1S/C12H16O/c1-3-5-10-6-8-11(9-7-10)12(13)4-2/h6-9H,3-5H2,1-2H3 |
| InChIKey |
FDSYYILHBJMPTN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
176.259 g/mol |
| Nominal Mass |
176 u |
| Quality |
989 |
| Retention Index |
1469 |
| SMILES |
C=1(C(CC)=O)C=CC(=CC1)CCC |
| SPLASH |
splash10-0002-3900000000-8167d8dcc2cea8a4ddf0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(4-Propylphenyl)propan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015402 |
