SpectraBase Compound ID | 4IJOWVV2BzM |
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InChI | InChI=1S/C21H16/c1-3-9-16(10-4-1)20-15-18-13-7-8-14-19(18)21(20)17-11-5-2-6-12-17/h1-14H,15H2 |
InChIKey | PANZFQYXPMCHFD-UHFFFAOYSA-N |
Mol Weight | 268.36 g/mol |
Molecular Formula | C21H16 |
Exact Mass | 268.125201 g/mol |
SpectraBase Spectrum ID | 6vpGS0NSTZ3 |
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Name | 2,3-Diphenyl-1H-indene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 268.125200515 u |
Formula | C21H16 |
InChI | InChI=1S/C21H16/c1-3-9-16(10-4-1)20-15-18-13-7-8-14-19(18)21(20)17-11-5-2-6-12-17/h1-14H,15H2 |
InChIKey | PANZFQYXPMCHFD-UHFFFAOYSA-N |
SMILES | C1(=C(C2=CC=CC=C2C1)C1=CC=CC=C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.985675 |