| SpectraBase Compound ID | 9cH8ET7bszH |
|---|---|
| InChI | InChI=1S/C19H14/c1-13-6-11-18-16(12-13)10-9-15-8-7-14-4-2-3-5-17(14)19(15)18/h2-12H,1H3 |
| InChIKey | HFBPJADWYSMWGU-UHFFFAOYSA-N |
| Mol Weight | 242.32 g/mol |
| Molecular Formula | C19H14 |
| Exact Mass | 242.10955 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | R9NnMu7YYx |
|---|---|
| Name | 3-Methylbenzo[C]phenanthrene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.109550451 u |
| Formula | C19H14 |
| InChI | InChI=1S/C19H14/c1-13-6-11-18-16(12-13)10-9-15-8-7-14-4-2-3-5-17(14)19(15)18/h2-12H,1H3 |
| InChIKey | HFBPJADWYSMWGU-UHFFFAOYSA-N |
| Molecular Weight | 242.321 g/mol |
| SMILES | C=1(C)C=CC=2C=3C=4C=CC=CC4C=CC3C=CC2C1 |