SpectraBase Spectrum ID |
1aJuMMzmeUA |
Name |
Flavanone (N-pentyl)hydrazone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
308.188863400 u |
Formula |
C20H24N2O |
InChI |
InChI=1S/C20H24N2O/c1-2-3-9-14-21-22-18-15-20(16-10-5-4-6-11-16)23-19-13-8-7-12-17(18)19/h4-8,10-13,20-21H,2-3,9,14-15H2,1H3/b22-18+ |
InChIKey |
XCMMMANVNSSZPP-RELWKKBWSA-N |
SMILES |
C1(OC2=C(\C(C1)=N/NCCCCC)C=CC=C2)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902627 |