SpectraBase Spectrum ID |
FJ1TI5SgeZK |
Name |
(E)-3,3'-Dimethoxy-4,4'-dinitrostilbene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
330.085186173 u |
Formula |
C16H14N2O6 |
InChI |
InChI=1S/C16H14N2O6/c1-23-15-9-11(5-7-13(15)17(19)20)3-4-12-6-8-14(18(21)22)16(10-12)24-2/h3-10H,1-2H3/b4-3+ |
InChIKey |
HHKHJEVMUAFIFA-ONEGZZNKSA-N |
Molecular Weight |
330.296 g/mol |
SMILES |
C=1(\C=C\C=2C=C(C(=CC2)N(=O)=O)OC)C=C(C(=CC1)N(=O)=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976268 |