| SpectraBase Spectrum ID |
2kwXYAluIme |
| Name |
3,4-Methylenedioxyacetophenone |
| CAS Registry Number |
3162-29-6 |
| 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 |
164.047344115 u |
| Formula |
C9H8O3 |
| InChI |
InChI=1S/C9H8O3/c1-6(10)7-2-3-8-9(4-7)12-5-11-8/h2-4H,5H2,1H3 |
| InChIKey |
BMHMKWXYXFBWMI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
164.160 g/mol |
| Nominal Mass |
164 u |
| Quality |
992 |
| Retention Index |
1392 |
| SMILES |
C1=2C(=CC=C(C2)C(=O)C)OCO1 |
| SPLASH |
splash10-01ot-3900000000-1e5542c802b0b0050260 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(1,3-Benzodioxol-5-yl)ethanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014714 |
