SpectraBase Spectrum ID |
Lc9mdaF7kqu |
Name |
2,7-bis-(4-Piperidin-1-yl-butoxy)-fluoren-9-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
490.319543217 u |
Formula |
C31H42N2O3 |
InChI |
InChI=1S/C31H42N2O3/c34-31-29-23-25(35-21-9-7-19-32-15-3-1-4-16-32)11-13-27(29)28-14-12-26(24-30(28)31)36-22-10-8-20-33-17-5-2-6-18-33/h11-14,23-24H,1-10,15-22H2 |
InChIKey |
BOGLFXJEIHQFOC-UHFFFAOYSA-N |
Molecular Weight |
490.688 g/mol |
SMILES |
C=12C(C3=CC(OCCCCN4CCCCC4)=CC=C3C1C=CC(=C2)OCCCCN1CCCCC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950499 |