| SpectraBase Spectrum ID |
BDWxVcgFs6F |
| Name |
Benzaldehyde, 3-(2-nitrophenoxymethyl)-4-methoxy- |
| 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/c1-20-14-7-6-11(9-17)8-12(14)10-21-15-5-3-2-4-13(15)16(18)19/h2-9H,10H2,1H3 |
| InChIKey |
OJLZETGPULWKBY-UHFFFAOYSA-N |
| SMILES |
C1=CC=C(N(=O)=O)C(=C1)OCC1=C(C=CC(=C1)C=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971072 |