| SpectraBase Spectrum ID |
BRHEBoRXFJF |
| Name |
Butanal, 2-ethyl-2-(hydroxymethyl)-, 2-(2,4-dinitrophenyl)hydrazone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.127719691 u |
| Formula |
C13H18N4O5 |
| InChI |
InChI=1S/C13H18N4O5/c1-3-13(4-2,9-18)8-14-15-11-6-5-10(16(19)20)7-12(11)17(21)22/h5-8,15,18H,3-4,9H2,1-2H3/b14-8+ |
| InChIKey |
VWYKLLSYKBJUDC-RIYZIHGNSA-N |
| Molecular Weight |
310.310 g/mol |
| SMILES |
CCC(CC)(CO)\C=N\NC1=CC=C(C=C1N(=O)=O)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873686 |
