| SpectraBase Spectrum ID |
47uEmxTmjvx |
| Name |
(2-Bromocyclohex-1-enyl)(naphthalen-2-yl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.030628102 u |
| Formula |
C17H15BrO |
| InChI |
InChI=1S/C17H15BrO/c18-16-8-4-3-7-15(16)17(19)14-10-9-12-5-1-2-6-13(12)11-14/h1-2,5-6,9-11H,3-4,7-8H2 |
| InChIKey |
ZZTJUGNSIDSQQM-UHFFFAOYSA-N |
| Molecular Weight |
315.210 g/mol |
| SMILES |
C12=CC=C(C(C=3CCCCC3Br)=O)C=C1C=CC=C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950845 |
