| SpectraBase Spectrum ID |
JEtJjrQUltY |
| Name |
3-Methoxy-4,5-methylenedioxybenzaldehyde |
| CAS Registry Number |
5780-07-4 |
| 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 |
180.042258734 u |
| Formula |
C9H8O4 |
| InChI |
InChI=1S/C9H8O4/c1-11-7-2-6(4-10)3-8-9(7)13-5-12-8/h2-4H,5H2,1H3 |
| InChIKey |
LOFRBHZYZCIOJO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
180.159 g/mol |
| Nominal Mass |
180 u |
| Quality |
992 |
| Retention Index |
1581 |
| SMILES |
C1=2C(=CC(=CC2OC)C=O)OCO1 |
| SPLASH |
splash10-0059-3900000000-07ae236f9f235d9c157c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Myristicin aldehyde
7-Methoxy-1,3-benzodioxole-5-carbaldehyde |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002001 |
