![4,12-Dimethylbenz[A]anthracene](/api/spectrum/Ij4KdRZLEz3/structure.png?h=300&w=458 "4,12-Dimethylbenz[A]anthracene")
| SpectraBase Compound ID | HHqoMxL5GY8 |
|---|---|
| InChI | InChI=1S/C20H16/c1-13-6-5-9-19-17(13)11-10-16-12-15-7-3-4-8-18(15)14(2)20(16)19/h3-12H,1-2H3 |
| InChIKey | DJVUGBOORPOCHQ-UHFFFAOYSA-N |
| Mol Weight | 256.35 g/mol |
| Molecular Formula | C20H16 |
| Exact Mass | 256.125201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ij4KdRZLEz3 |
|---|---|
| Name | 4,12-Dimethylbenz[A]anthracene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.125200515 u |
| Formula | C20H16 |
| InChI | InChI=1S/C20H16/c1-13-6-5-9-19-17(13)11-10-16-12-15-7-3-4-8-18(15)14(2)20(16)19/h3-12H,1-2H3 |
| InChIKey | DJVUGBOORPOCHQ-UHFFFAOYSA-N |
| Molecular Weight | 256.348 g/mol |
| SMILES | C1=2C(=CC=CC2)C(=C2C(=C1)C=CC1=C2C=CC=C1C)C |