SpectraBase Compound ID | Hvx8w425hWP |
---|---|
InChI | InChI=1S/C20H16/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H |
InChIKey | MKYQPGPNVYRMHI-UHFFFAOYSA-N |
Mol Weight | 256.35 g/mol |
Molecular Formula | C20H16 |
Exact Mass | 256.125201 g/mol |
SpectraBase Spectrum ID | KVA3tk0ZiHx |
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Name | Triphenylethylene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 256.125200515 u |
Formula | C20H16 |
InChI | InChI=1S/C20H16/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H |
InChIKey | MKYQPGPNVYRMHI-UHFFFAOYSA-N |
Molecular Weight | 256.348 g/mol |
SMILES | C=1C(=CC=CC1)C(=CC=1C=CC=CC1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Raman) | 0.901588 |