| SpectraBase Spectrum ID |
8IeyqAqJjSS |
| Name |
3,4-Methylenedioxy-6-nitro-benzaldehyde |
| CAS Registry Number |
712-97-0 |
| 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 |
195.016772260 u |
| Formula |
C8H5NO5 |
| InChI |
InChI=1S/C8H5NO5/c10-3-5-1-7-8(14-4-13-7)2-6(5)9(11)12/h1-3H,4H2 |
| InChIKey |
NRZWECORTTWSEF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
195.130 g/mol |
| Nominal Mass |
195 u |
| Quality |
994 |
| Retention Index |
1720 |
| SMILES |
C1(=C(C=C2C(=C1)OCO2)C=O)[N+](=O)[O-] |
| SPLASH |
splash10-0j4i-9400000000-5b043acce3bb4e9caf2a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6-Nitrobenzo[1,3]dioxole-5-carbaldehyde |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002155 |
