SpectraBase Spectrum ID |
8LnBl7IIr0 |
Name |
2-Pentyl-2,3,4,9-tetrahydro-1H-fluorene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
240.187800773 u |
Formula |
C18H24 |
InChI |
InChI=1S/C18H24/c1-2-3-4-7-14-10-11-18-16(12-14)13-15-8-5-6-9-17(15)18/h5-6,8-9,14H,2-4,7,10-13H2,1H3 |
InChIKey |
KPWULZOICLYRDI-UHFFFAOYSA-N |
Molecular Weight |
240.390 g/mol |
SMILES |
C1(CC2=C(CC1)C1=CC=CC=C1C2)CCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872882 |