| SpectraBase Spectrum ID |
8Fkzr5vuzXU |
| Name |
1-(2,4,5-Trimethoxyphenyl)propan-2-one |
| CAS Registry Number |
2020-90-8 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
224.104858991 u |
| Formula |
C12H16O4 |
| InChI |
InChI=1S/C12H16O4/c1-5-9(13)8-6-11(15-3)12(16-4)7-10(8)14-2/h6-7H,5H2,1-4H3 |
| InChIKey |
KUQHFNICKXWOBZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
224.256 g/mol |
| Nominal Mass |
224 u |
| Quality |
987 |
| Retention Index |
1709 |
| SMILES |
C=1(C(=CC(=C(C1)OC)OC)OC)C(CC)=O |
| SPLASH |
splash10-001i-3900000000-52bbd8cfc12fba35cdd4 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(2,4,5-Trimethoxyphenyl)acetone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_023829 |
