| SpectraBase Spectrum ID |
BPWdd4bhGpc |
| Name |
9-Bromo-9-(cyclonona-2' ,4' ,6' ,8'-tetraen-1'-yl)fluorene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
360.051363547 u |
| Formula |
C22H17Br |
| InChI |
InChI=1S/C22H17Br/c23-22(17-11-5-3-1-2-4-6-12-17)20-15-9-7-13-18(20)19-14-8-10-16-21(19)22/h1-17H/b3-1-,4-2-,11-5-,12-6- |
| InChIKey |
GXAFSJSAVUZGAR-ATQWCYCASA-N |
| Molecular Weight |
361.282 g/mol |
| SMILES |
C1(C=2C(=CC=CC2)C2=C1C=CC=C2)(C1\C=C/C=C\C=C/C=C\1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960609 |