| SpectraBase Spectrum ID |
KndCHGgyjpS |
| Name |
(Z)-3-(2-Benzoxy-4,5-dimethoxy-phenyl)-2-nitro-acrylic acid ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.131802013 u |
| Formula |
C20H21NO7 |
| InChI |
InChI=1S/C20H21NO7/c1-4-27-20(22)16(21(23)24)10-15-11-18(25-2)19(26-3)12-17(15)28-13-14-8-6-5-7-9-14/h5-12H,4,13H2,1-3H3/b16-10- |
| InChIKey |
PCQNGZQNXGGABK-YBEGLDIGSA-N |
| Molecular Weight |
387.388 g/mol |
| SMILES |
C(\C(=C\C=1C(=CC(=C(C1)OC)OC)OCC=1C=CC=CC1)N(=O)=O)(=O)OCC |
