SpectraBase Spectrum ID |
8adQZWVesHq |
Name |
2-[(2-Bromophenyl)carbonyl]cyclohex-1-ene-1-carbaldehyde |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
292.009892657 u |
Formula |
C14H13BrO2 |
InChI |
InChI=1S/C14H13BrO2/c15-13-8-4-3-7-12(13)14(17)11-6-2-1-5-10(11)9-16/h3-4,7-9H,1-2,5-6H2 |
InChIKey |
LBLTVLZNNRZMIH-UHFFFAOYSA-N |
SMILES |
C(C1=CC=CC=C1Br)(=O)C=1CCCCC1C=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960718 |