| SpectraBase Spectrum ID |
IvaFNx0OZQb |
| Name |
Pipamperone or 1'-[4-(4-fluorophenyl)-4-oxobutyl]-[1,4'-bipiperidine]-4'-carboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
375.232205379 u |
| Formula |
C21H30FN3O2 |
| InChI |
InChI=1S/C21H30FN3O2/c22-18-5-3-16(4-6-18)20(26)2-1-11-24-12-9-19(10-13-24)25-14-7-17(8-15-25)21(23)27/h3-6,17,19H,1-2,7-15H2,(H2,23,27) |
| InChIKey |
LQVWYPKDYNHNFJ-UHFFFAOYSA-N |
| Molecular Weight |
375.488 g/mol |
| SMILES |
C1(N2CCC(C(=O)N)CC2)CCN(CC1)CCCC(C1=CC=C(C=C1)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.800581 |
![Pipamperone or 1'-[4-(4-fluorophenyl)-4-oxobutyl]-[1,4'-bipiperidine]-4'-carboxamide](/api/spectrum/IvaFNx0OZQb/structure.png?h=300&w=458 "Pipamperone or 1'-[4-(4-fluorophenyl)-4-oxobutyl]-[1,4'-bipiperidine]-4'-carboxamide")
