| SpectraBase Spectrum ID |
2Cx60uXHG5x |
| Name |
2-Amino-4-(p-nitrophenyl)-5,6,7,8-tetrahydro-1,3-naphthalene-dicarbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.111675705 u |
| Formula |
C18H14N4O2 |
| InChI |
InChI=1S/C18H14N4O2/c19-9-15-13-3-1-2-4-14(13)17(16(10-20)18(15)21)11-5-7-12(8-6-11)22(23)24/h5-8H,1-4,21H2 |
| InChIKey |
KESCTIMUZOIRIZ-UHFFFAOYSA-N |
| SMILES |
NC=1C(=C(C=2CCCCC2C1C#N)C1=CC=C(C=C1)N(=O)=O)C#N |
| Spectrum/Structure Validation Score (Raman) |
0.718142 |
