SpectraBase Compound ID | wdi0iTQF7A |
---|---|
InChI | InChI=1S/C15H9BrO/c16-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)15(14)17/h1-9H |
InChIKey | CJOWXJUZHXADJV-UHFFFAOYSA-N |
Mol Weight | 285.14 g/mol |
Molecular Formula | C15H9BrO |
Exact Mass | 283.983678 g/mol |
SpectraBase Spectrum ID | GbZS484zs4D |
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Name | 2-Bromo-3-phenyl-1-indenone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 283.983677909 u |
Formula | C15H9BrO |
InChI | InChI=1S/C15H9BrO/c16-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)15(14)17/h1-9H |
InChIKey | CJOWXJUZHXADJV-UHFFFAOYSA-N |
SMILES | C12=C(C(=O)C(=C2C2=CC=CC=C2)Br)C=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.897588 |