| SpectraBase Compound ID | sMP9s4xlcC |
|---|---|
| InChI | InChI=1S/C18H22/c1(5-11-17-13-7-3-8-14-17)2-6-12-18-15-9-4-10-16-18/h3-4,7-10,13-16H,1-2,5-6,11-12H2 |
| InChIKey | DVGPMIRVCZNXMD-UHFFFAOYSA-N |
| Mol Weight | 238.37 g/mol |
| Molecular Formula | C18H22 |
| Exact Mass | 238.172151 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IFbQtZaJHFv |
|---|---|
| Name | 1,6-Diphenylhexane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.172150708 u |
| Formula | C18H22 |
| InChI | InChI=1S/C18H22/c1(5-11-17-13-7-3-8-14-17)2-6-12-18-15-9-4-10-16-18/h3-4,7-10,13-16H,1-2,5-6,11-12H2 |
| InChIKey | DVGPMIRVCZNXMD-UHFFFAOYSA-N |
| Molecular Weight | 238.374 g/mol |
| SMILES | C=1C(=CC=CC1)CCCCCCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.936962 |