| SpectraBase Spectrum ID |
2FhioFxikuJ |
| Name |
2-Propen-1-one, 1-(4,5-dimethoxy-2-nitrophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)- |
| CAS Registry Number |
76787-22-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H14N2O9 |
| InChI |
InChI=1S/C18H14N2O9/c1-26-15-6-11(13(20(24)25)8-16(15)27-2)14(21)4-3-10-5-17-18(29-9-28-17)7-12(10)19(22)23/h3-8H,9H2,1-2H3/b4-3+ |
| InChIKey |
CHORCGXQSFAZSS-ONEGZZNKSA-N |
| Molecular Weight |
402.315 g/mol |
| SMILES |
c1(N(=O)=O)c(cc(c(c1)OC)OC)C(\C=C\c1c(N(=O)=O)cc2c(c1)OCO2)=O |
| SPLASH |
splash10-0a4i-0009000000-34cf58b9890c9132e942 |
| Source of Spectrum |
Y-17-1493-0 |
| Synonyms |
(2E)-1-(4,5-dimethoxy-2-nitrophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propen-1-one
1-(4,5-Dimethoxy-2-nitrophenyl)-3-(4,5-methylenedioxy-2-nitrophenyl)-2-propen-1-one |
| Wiley ID |
1370193 |
