| SpectraBase Spectrum ID |
K4hmG59ZtSq |
| Name |
1-[2-[2-Hydroxy-3-[4-(2-methyl-4-phenyl)-1-piperazinyl]propoxy)phenyl]-3-phenyl-1-propanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
458.256942960 u |
| Formula |
C29H34N2O3 |
| InChI |
InChI=1S/C29H34N2O3/c1-23-9-5-7-13-27(23)31-19-17-30(18-20-31)21-25(32)22-34-29-14-8-6-12-26(29)28(33)16-15-24-10-3-2-4-11-24/h2-14,25,32H,15-22H2,1H3 |
| InChIKey |
LEJULLXRCKWRTM-UHFFFAOYSA-N |
| Molecular Weight |
458.602 g/mol |
| SMILES |
C1(N2CCN(CC2)CC(COC=2C(C(=O)CCC3=CC=CC=C3)=CC=CC2)O)=C(C)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947929 |
![1-[2-[2-Hydroxy-3-[4-(2-methyl-4-phenyl)-1-piperazinyl]propoxy)phenyl]-3-phenyl-1-propanone](/api/spectrum/K4hmG59ZtSq/structure.png?h=300&w=458 "1-[2-[2-Hydroxy-3-[4-(2-methyl-4-phenyl)-1-piperazinyl]propoxy)phenyl]-3-phenyl-1-propanone")
