| SpectraBase Spectrum ID |
DxiEn7YW8mi |
| Name |
4-(4-Chlorophenyl)-N-[3-(1,2,3,4-tetrahydro-5-methoxy-1-naphthalenyl]-1-piperazineethanamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
399.207740297 u |
| Formula |
C23H30ClN3O |
| InChI |
InChI=1S/C23H30ClN3O/c1-28-23-7-3-4-20-21(23)5-2-6-22(20)25-12-13-26-14-16-27(17-15-26)19-10-8-18(24)9-11-19/h3-4,7-11,22,25H,2,5-6,12-17H2,1H3 |
| InChIKey |
CIXHJOHVILFKGB-UHFFFAOYSA-N |
| Molecular Weight |
399.966 g/mol |
| SMILES |
C1(N2CCN(CC2)CCNC2C=3C(=C(OC)C=CC3)CCC2)=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825839 |
![4-(4-Chlorophenyl)-N-[3-(1,2,3,4-tetrahydro-5-methoxy-1-naphthalenyl]-1-piperazineethanamine](/api/spectrum/DxiEn7YW8mi/structure.png?h=300&w=458 "4-(4-Chlorophenyl)-N-[3-(1,2,3,4-tetrahydro-5-methoxy-1-naphthalenyl]-1-piperazineethanamine")
