SpectraBase Compound ID | FyJNo5sny3Z |
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InChI | InChI=1S/C24H18/c1-4-10-19(11-5-1)22-16-23(20-12-6-2-7-13-20)18-24(17-22)21-14-8-3-9-15-21/h1-18H |
InChIKey | SXWIAEOZZQADEY-UHFFFAOYSA-N |
Mol Weight | 306.41 g/mol |
Molecular Formula | C24H18 |
Exact Mass | 306.140851 g/mol |
SpectraBase Spectrum ID | 8bYst9dPz9 |
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Name | 1,3,5-Triphenylbenzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 306.140850580 u |
Formula | C24H18 |
InChI | InChI=1S/C24H18/c1-4-10-19(11-5-1)22-16-23(20-12-6-2-7-13-20)18-24(17-22)21-14-8-3-9-15-21/h1-18H |
InChIKey | SXWIAEOZZQADEY-UHFFFAOYSA-N |
SMILES | C=1C(=CC=CC1)C=1C=C(C=C(C1)C=1C=CC=CC1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Raman) | 0.995488 |