SpectraBase Spectrum ID |
JJbbGNAmUaG |
Name |
3,4-Methylenedioxypropiophenone |
CAS Registry Number |
28281-49-4 |
Classification |
Designer 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 |
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 |
988 |
Retention Index |
1496 |
SMILES |
C1=2C(=CC=C(C2)C(CC)=O)OCO1 |
SPLASH |
splash10-0002-7900000000-b81284481ff4d29355fa |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(1,3-benzodioxol-5-yl)propan-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_010358 |