SpectraBase Spectrum ID |
DjaEdXrWxRz |
Name |
(E)-3-(2-(2,4-Dinitrophenyl)hydrazono)propan-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
254.065119433 u |
Formula |
C9H10N4O5 |
InChI |
InChI=1S/C9H10N4O5/c14-5-1-4-10-11-8-3-2-7(12(15)16)6-9(8)13(17)18/h2-4,6,11,14H,1,5H2/b10-4+ |
InChIKey |
VHHVXVAYAKGINZ-ONNFQVAWSA-N |
Molecular Weight |
254.202 g/mol |
SMILES |
C(O)C\C=N\NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89569 |