| SpectraBase Compound ID | 5N5AIuXn7k1 |
|---|---|
| InChI | InChI=1S/C15H16/c1-2-13-9-6-10-15(11-13)12-14-7-4-3-5-8-14/h3-11H,2,12H2,1H3 |
| InChIKey | DITPGLQNHCMPAK-UHFFFAOYSA-N |
| Mol Weight | 196.29 g/mol |
| Molecular Formula | C15H16 |
| Exact Mass | 196.125201 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HIXR0VE8iND |
|---|---|
| Name | Benzene, 1-ethyl-3-(phenylmethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.125200515 u |
| Formula | C15H16 |
| InChI | InChI=1S/C15H16/c1-2-13-9-6-10-15(11-13)12-14-7-4-3-5-8-14/h3-11H,2,12H2,1H3 |
| InChIKey | DITPGLQNHCMPAK-UHFFFAOYSA-N |
| Molecular Weight | 196.293 g/mol |
| SMILES | C1=C(C=CC=C1CC1=CC=CC=C1)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.882273 |