| SpectraBase Spectrum ID |
6Qu9Ja865ZQ |
| Name |
[2-(4-Benzyl-2,2-dimethyltetrahydropyran-4-yl)ethyl](4-fluorobenzyl)amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.231142752 u |
| Formula |
C23H30FNO |
| InChI |
InChI=1S/C23H30FNO/c1-22(2)18-23(13-15-26-22,16-19-6-4-3-5-7-19)12-14-25-17-20-8-10-21(24)11-9-20/h3-11,25H,12-18H2,1-2H3 |
| InChIKey |
IZRHCTRCYUGXAD-UHFFFAOYSA-N |
| Molecular Weight |
355.497 g/mol |
| SMILES |
C1(CC(C)(C)OCC1)(CC=1C=CC=CC1)CCNCC=1C=CC(=CC1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915354 |