| SpectraBase Spectrum ID |
DEHEMrs0bib |
| Name |
Benzene, 1-(2-ethylphenoxy)-2,4-dinitro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.074621489 u |
| Formula |
C14H12N2O5 |
| InChI |
InChI=1S/C14H12N2O5/c1-2-10-5-3-4-6-13(10)21-14-8-7-11(15(17)18)9-12(14)16(19)20/h3-9H,2H2,1H3 |
| InChIKey |
UEWTVDIRJVYWCZ-UHFFFAOYSA-N |
| SMILES |
C1(OC2=C(CC)C=CC=C2)=C(N(=O)=O)C=C(C=C1)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97289 |
