| SpectraBase Spectrum ID |
APl6AXfIBqc |
| Name |
1-[2-(N,N-Dimethylanilin-4-yl)ethoxy]-8-(1-pyrenylmethoxy)octane |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
507.313729562 u |
| Formula |
C35H41NO2 |
| InChI |
InChI=1S/C35H41NO2/c1-36(2)32-19-12-27(13-20-32)22-25-37-23-7-5-3-4-6-8-24-38-26-31-17-16-30-15-14-28-10-9-11-29-18-21-33(31)35(30)34(28)29/h9-21H,3-8,22-26H2,1-2H3 |
| InChIKey |
UXUXOQWHDGPCLG-UHFFFAOYSA-N |
| Molecular Weight |
507.718 g/mol |
| SMILES |
C1=2C=3C=CC=4C2C(C=CC4)=CC=C1C=CC3COCCCCCCCCOCCC1=CC=C(C=C1)N(C)C |