| SpectraBase Spectrum ID |
FqZvvgYEcBw |
| Name |
2-Acetylamino-7-hydroxy-6-N-hexyl-4-(4-chlorophenyl)-4H-chromene-3-carbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
424.155370370 u |
| Formula |
C24H25ClN2O3 |
| InChI |
InChI=1S/C24H25ClN2O3/c1-3-4-5-6-7-17-12-19-22(13-21(17)29)30-24(27-15(2)28)20(14-26)23(19)16-8-10-18(25)11-9-16/h8-13,23,29H,3-7H2,1-2H3,(H,27,28) |
| InChIKey |
LHORCKJYZCPYJG-UHFFFAOYSA-N |
| Molecular Weight |
424.928 g/mol |
| SMILES |
C1(=C(C(C=2C=C(C(=CC2O1)O)CCCCCC)C=1C=CC(=CC1)Cl)C#N)NC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.812861 |
