| SpectraBase Spectrum ID |
4LndSHosETj |
| Name |
Benzo[F]isoquinoline, 1,2-dihydro-2,2-dimethyl-4-[2-(1-piperidyl)ethyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.225248910 u |
| Formula |
C22H28N2 |
| InChI |
InChI=1S/C22H28N2/c1-22(2)16-20-18-9-5-4-8-17(18)10-11-19(20)21(23-22)12-15-24-13-6-3-7-14-24/h4-5,8-11H,3,6-7,12-16H2,1-2H3 |
| InChIKey |
JEQBWWPAELPHQM-UHFFFAOYSA-N |
| Molecular Weight |
320.480 g/mol |
| SMILES |
C12=C3C(C=CC=C3)=CC=C1C(=NC(C2)(C)C)CCN1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.802889 |