| SpectraBase Spectrum ID |
KqApGyRIRbb |
| Name |
1-Bromo-2-[cyclopropylidene(o-tolyl)methyl]benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.035713483 u |
| Formula |
C17H15Br |
| InChI |
InChI=1S/C17H15Br/c1-12-6-2-3-7-14(12)17(13-10-11-13)15-8-4-5-9-16(15)18/h2-9H,10-11H2,1H3 |
| InChIKey |
SGJRRXJSUSMQJP-UHFFFAOYSA-N |
| SMILES |
C1=C(C(=CC=C1)C(=C1CC1)C1=CC=CC=C1C)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96447 |
