| SpectraBase Spectrum ID |
4ZvZim6YwKn |
| Name |
1-(2-Bromonaphthalen-1-yl)-2-(4-methylphenyl)naphthalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
422.067013612 u |
| Formula |
C27H19Br |
| InChI |
InChI=1S/C27H19Br/c1-18-10-12-21(13-11-18)24-16-14-19-6-2-4-8-22(19)26(24)27-23-9-5-3-7-20(23)15-17-25(27)28/h2-17H,1H3 |
| InChIKey |
XSZWBAVTSGDNGA-UHFFFAOYSA-N |
| Molecular Weight |
423.353 g/mol |
| SMILES |
C1(C2=C3C(C=CC=C3)=CC=C2Br)=C(C=CC=2C1=CC=CC2)C1=CC=C(C=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.855975 |
