SpectraBase Spectrum ID |
IBWcknWLsUH |
Name |
9-(2,2-Dimethyl-5-hexenyl)-9-phenylfluorene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
352.219100902 u |
Formula |
C27H28 |
InChI |
InChI=1S/C27H28/c1-4-5-19-26(2,3)20-27(21-13-7-6-8-14-21)24-17-11-9-15-22(24)23-16-10-12-18-25(23)27/h4,6-18H,1,5,19-20H2,2-3H3 |
InChIKey |
LQVOUZAGNJMPCY-UHFFFAOYSA-N |
Molecular Weight |
352.521 g/mol |
SMILES |
C1(C2=C(C=CC=C2)C2=C1C=CC=C2)(CC(CCC=C)(C)C)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.800417 |