| SpectraBase Spectrum ID |
J4c3JKroxcQ |
| Name |
2,6-Dibromophenyl .beta.-phenylpropionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
381.920405624 u |
| Formula |
C15H12Br2O2 |
| InChI |
InChI=1S/C15H12Br2O2/c16-12-7-4-8-13(17)15(12)19-14(18)10-9-11-5-2-1-3-6-11/h1-8H,9-10H2 |
| InChIKey |
NRJUTDGERPLESI-UHFFFAOYSA-N |
| Molecular Weight |
384.067 g/mol |
| SMILES |
C1=CC=C(C(=C1Br)OC(=O)CCC1=CC=CC=C1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.848264 |
