| SpectraBase Spectrum ID |
GfOuIftiAGG |
| Name |
(3,4-Dimethoxyphenyl)(4-nitrophenyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
287.079372518 u |
| Formula |
C15H13NO5 |
| InChI |
InChI=1S/C15H13NO5/c1-20-13-8-5-11(9-14(13)21-2)15(17)10-3-6-12(7-4-10)16(18)19/h3-9H,1-2H3 |
| InChIKey |
XZDQUXXBVWOUPE-UHFFFAOYSA-N |
| SMILES |
C1(=CC(C(=O)C2=CC=C(C=C2)N(=O)=O)=CC=C1OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907082 |
