| SpectraBase Spectrum ID |
GWvdu8MbWdh |
| Name |
Pentane-1,5-diamide, N,N'-bis(2-nitrophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
372.106984245 u |
| Formula |
C17H16N4O6 |
| InChI |
InChI=1S/C17H16N4O6/c22-16(18-12-6-1-3-8-14(12)20(24)25)10-5-11-17(23)19-13-7-2-4-9-15(13)21(26)27/h1-4,6-9H,5,10-11H2,(H,18,22)(H,19,23) |
| InChIKey |
MLJHGYXMONRXEY-UHFFFAOYSA-N |
| Molecular Weight |
372.337 g/mol |
| SMILES |
C1=CC=C(N(=O)=O)C(=C1)NC(=O)CCCC(NC=1C(N(=O)=O)=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842471 |
