| SpectraBase Compound ID | 93WBlGs3FpV |
|---|---|
| InChI | InChI=1S/C18H14/c1-11-10-12(2)16-9-7-14-5-3-4-13-6-8-15(11)18(16)17(13)14/h3-10H,1-2H3 |
| InChIKey | UWCWYAZCQUDPOX-UHFFFAOYSA-N |
| Mol Weight | 230.31 g/mol |
| Molecular Formula | C18H14 |
| Exact Mass | 230.10955 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7FU1xlbnQ5i |
|---|---|
| Name | 1,3-Dimethylpyrene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.109550451 u |
| Formula | C18H14 |
| InChI | InChI=1S/C18H14/c1-11-10-12(2)16-9-7-14-5-3-4-13-6-8-15(11)18(16)17(13)14/h3-10H,1-2H3 |
| InChIKey | UWCWYAZCQUDPOX-UHFFFAOYSA-N |
| Molecular Weight | 230.310 g/mol |
| SMILES | C1=2C3=CC=CC2C=CC=2C(=CC(=C(C=C3)C12)C)C |
| Spectrum/Structure Validation Score (Raman) | 0.942121 |