| SpectraBase Spectrum ID |
8JyskrLxyym |
| Name |
3,4-Methylenedioxypropiophenone |
| CAS Registry Number |
28281-49-4 |
| Classification |
Designer 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 |
178.062994179 u |
| Formula |
C10H10O3 |
| InChI |
InChI=1S/C10H10O3/c1-2-8(11)7-3-4-9-10(5-7)13-6-12-9/h3-5H,2,6H2,1H3 |
| InChIKey |
RVBJGSPBFIUTTR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
178.187 g/mol |
| Nominal Mass |
178 u |
| Quality |
944 |
| Retention Index |
1496 |
| SMILES |
C1=2C(=CC=C(C2)C(CC)=O)OCO1 |
| SPLASH |
splash10-0002-4900000000-71bc1e2d564a81eb84b3 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(1,3-benzodioxol-5-yl)propan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_017093 |
