SpectraBase Spectrum ID |
KHrZiLAaylk |
Name |
2,2-Dimethylchroman-4-one (2,4,6-trichlorophenyl)hydrazone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
368.024996210 u |
Formula |
C17H15Cl3N2O |
InChI |
InChI=1S/C17H15Cl3N2O/c1-17(2)9-14(11-5-3-4-6-15(11)23-17)21-22-16-12(19)7-10(18)8-13(16)20/h3-8,22H,9H2,1-2H3/b21-14+ |
InChIKey |
BBYQOGSXDITZSO-KGENOOAVSA-N |
Molecular Weight |
369.679 g/mol |
SMILES |
C1(OC2=CC=CC=C2\C(C1)=N\NC1=C(C=C(C=C1Cl)Cl)Cl)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826052 |