SpectraBase Spectrum ID |
FsKs87FvfJL |
Name |
Carbonic acid, p-bromophenyl phenyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
291.973507147 u |
Formula |
C13H9BrO3 |
InChI |
InChI=1S/C13H9BrO3/c14-10-6-8-12(9-7-10)17-13(15)16-11-4-2-1-3-5-11/h1-9H |
InChIKey |
LPUCIXPKNBIPKF-UHFFFAOYSA-N |
Molecular Weight |
293.116 g/mol |
SMILES |
C(OC1=CC=C(C=C1)Br)(OC1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938309 |