SpectraBase Spectrum ID |
3mJnfw6p5Js |
Name |
6,7-Dimethoxy-5-(3-phenoxyphenylacetoxy)-1,4-dihydroquinoxaline-2,3-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
448.127050985 u |
Formula |
C24H20N2O7 |
InChI |
InChI=1S/C24H20N2O7/c1-30-18-13-17-20(26-24(29)23(28)25-17)22(21(18)31-2)33-19(27)12-14-7-6-10-16(11-14)32-15-8-4-3-5-9-15/h3-11,13H,12H2,1-2H3,(H,25,28)(H,26,29) |
InChIKey |
VRLYIQIIBPQYFY-UHFFFAOYSA-N |
Molecular Weight |
448.431 g/mol |
SMILES |
C1=2C(=C(OC)C(=CC2NC(=O)C(N1)=O)OC)OC(=O)CC=1C=C(OC=2C=CC=CC2)C=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953321 |