| SpectraBase Spectrum ID |
BVUf8jwvqH1 |
| Name |
N-(p-Nitrophenethyl)aniline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.105527697 u |
| Formula |
C14H14N2O2 |
| InChI |
InChI=1S/C14H14N2O2/c17-16(18)14-8-6-12(7-9-14)10-11-15-13-4-2-1-3-5-13/h1-9,15H,10-11H2 |
| InChIKey |
LQJZGKMOBIDDGP-UHFFFAOYSA-N |
| Molecular Weight |
242.278 g/mol |
| SMILES |
C1=C(NCCC2=CC=C(C=C2)N(=O)=O)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958145 |
