| SpectraBase Spectrum ID |
JHG952IwHKK |
| Name |
1-(3,4-Methylenedioxyphenyl)propan-2-one |
| CAS Registry Number |
4676-39-5 |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
178.062994179 u |
| Formula |
C10H10O3 |
| InChI |
InChI=1S/C10H10O3/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5H,4,6H2,1H3 |
| InChIKey |
XIYKRJLTYKUWAM-UHFFFAOYSA-N |
| Ionization Type |
Chemical Ionization (CI) |
| Molecular Weight |
178.187 g/mol |
| Nominal Mass |
178 u |
| Reagent Gas |
Methane |
| Retention Index |
1329 |
| SMILES |
C1=2C(=CC(=CC2)CC(=O)C)OCO1 |
| SPLASH |
splash10-004i-0900000000-35e559abe15cfd863453 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
MDP-2-P
1-(3,4-Methylenedioxyphenyl)-2-propanone
PMK
Piperonylmethylketone
1-(1,3-benzodioxol-5-yl)propan-2-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002267 |
