Systematic / IUPAC Name: 5-[(1E)-2-Nitro-1-propen-1-yl]-1,3-benzodioxole
ID: Reference3833
Other Names:
cis-3,4-Methylenedioxy-β-methyl-β-nitrostyrene;
1,2-Methylenedioxy-4-(2-nitropropenyl)benzene;
1,3-Benzodioxole, 5-(2-nitro-1-propenyl)-;
3,4-Methylenedioxy-1-(2-nitropropenyl)benzene;
3,4-Methylenedioxy-phenyl-2-nitropropene-
; more
Formula: C10H9NO4
5-(2-Nitroprop-1-enyl)-1,3-benzodioxole mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 67 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 2/15/2016 9:41:17 AM |
InChI | InChI=1S/C10H9NO4/c1-7(11(12)13)4-8-2-3-9-10(5-8)15-6-14-9/h2-5H,6H2,1H3/b7-4+ |
InChI Key | CCEVJKZHAJJQJR-QPJJXVBHSA-N |
Canonical SMILES | |
CAS | |
Splash | |
Other Names |
cis-3,4-Methylenedioxy-β-methyl-β-nitrostyrene; 1,2-Methylenedioxy-4-(2-nitropropenyl)benzene; 1,3-Benzodioxole, 5-(2-nitro-1-propenyl)-; 3,4-Methylenedioxy-1-(2-nitropropenyl)benzene; 3,4-Methylenedioxy-phenyl-2-nitropropene-; 5-((1E)-2-Nitroprop-1-enyl)-2H-benzo[d]1,3-dioxolene; 5-(2-Nitroprop-1-en-1-yl)benzo[d][1,3]dioxole; 5-[(1E)-2-Nitroprop-1-en-1-yl]-1,3-benzodioxole; Benzene, 1,2-(methylenedioxy)-4-(2-nitropropenyl)- |
ChEMBL | CHEMBL1632546 |
ChemSpider | 4525238 |
PubChem | 5375839 |