| SpectraBase Spectrum ID |
9Hmz4Zh3FPC |
| Name |
1,2-bis(4'-Nitrophenyl)-1,2-ethanediol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.069536108 u |
| Formula |
C14H12N2O6 |
| InChI |
InChI=1S/C14H12N2O6/c17-13(9-1-5-11(6-2-9)15(19)20)14(18)10-3-7-12(8-4-10)16(21)22/h1-8,13-14,17-18H |
| InChIKey |
XWBGSLWEJDNUTM-UHFFFAOYSA-N |
| Molecular Weight |
304.258 g/mol |
| SMILES |
C1(N(=O)=O)=CC=C(C(C(C2=CC=C(N(=O)=O)C=C2)O)O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965589 |
