| SpectraBase Spectrum ID |
B1Xn8dbhEXo |
| Name |
1-(2-Methoxy-4,5-methylenedioxyphenyl)-2-nitrobut-1-ene |
| Classification |
Phenylbutanamine designer drug precursor |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
251.079372518 u |
| Formula |
C12H13NO5 |
| InChI |
InChI=1S/C12H13NO5/c1-3-9(13(14)15)4-8-5-11-12(18-7-17-11)6-10(8)16-2/h4-6H,3,7H2,1-2H3/b9-4- |
| InChIKey |
XIGAFJWYNPYQGC-WTKPLQERSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
251.238 g/mol |
| Nominal Mass |
251 u |
| Quality |
995 |
| Retention Index |
1906 |
| SMILES |
C1(=C(C=C2C(=C1)OCO2)OC)\C=C\([N+](=O)[O-])CC |
| SPLASH |
splash10-0udi-3960000000-33feff4e5bacf8481581 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-methoxy-6-((1Z)-2-nitrobut-1-en-1-yl)-1,3-benzodioxole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002031 |
