| SpectraBase Compound ID | 2Pp1WQWPOaO |
|---|---|
| InChI | InChI=1S/C17H12/c1-11-5-6-14-8-7-12-3-2-4-13-9-10-15(11)17(14)16(12)13/h2-10H,1H3/i1D |
| InChIKey | KBSPJIWZDWBDGM-MICDWDOJSA-N |
| Mol Weight | 217.29 g/mol |
| Molecular Formula | C17H112D |
| Exact Mass | 217.100177 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1NZB2HXhSpo |
|---|---|
| Name | 1-Methylpyrene |
| CAS Registry Number | 98030-04-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H11D |
| InChI | InChI=1S/C17H12/c1-11-5-6-14-8-7-12-3-2-4-13-9-10-15(11)17(14)16(12)13/h2-10H,1H3/i1D |
| InChIKey | KBSPJIWZDWBDGM-MICDWDOJSA-N |
| Molecular Weight | 217.289 g/mol |
| SMILES | c1cc2c3c(ccc4c(ccc(cc2)c34)C[2D])c1 |
| SPLASH | splash10-014i-6390000000-5d053d8fb61fc1ada58c |
| Wiley ID | 1494157 |