| SpectraBase Spectrum ID |
5ZeGflMiozI |
| Name |
1-(2,3-Methylenedioxyphenyl)-2-nitrobut-1-ene |
| Classification |
Phenylbutanamine designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
221.068807834 u |
| Formula |
C11H11NO4 |
| InChI |
InChI=1S/C11H11NO4/c1-2-9(12(13)14)6-8-4-3-5-10-11(8)16-7-15-10/h3-6H,2,7H2,1H3/b9-6- |
| InChIKey |
WLWJWYOLCDHOIT-TWGQIWQCSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
221.212 g/mol |
| Nominal Mass |
221 u |
| Quality |
977 |
| Retention Index |
1697 |
| SMILES |
C1=2C(\C=C\([N+](=O)[O-])CC)=CC=CC2OCO1 |
| SPLASH |
splash10-0300-4920000000-319eae677325f52a8ffb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-((1Z)-2-nitrobut-1-en-1-yl)-1,3-benzodioxole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002237 |
