| SpectraBase Compound ID | 4ayp4CTOlKS |
|---|---|
| InChI | InChI=1S/C20H16O/c1-13-6-7-15-11-16(12-21)20-17-5-3-2-4-14(17)8-9-18(20)19(15)10-13/h2-11,21H,12H2,1H3 |
| InChIKey | CURGXFJWGBZQTC-UHFFFAOYSA-N |
| Mol Weight | 272.35 g/mol |
| Molecular Formula | C20H16O |
| Exact Mass | 272.120115 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B7tNHB8SubD |
|---|---|
| Name | 5-(Hydroxymethyl)-9-methylchrysene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H16O |
| InChI | InChI=1S/C20H16O/c1-13-6-7-15-11-16(12-21)20-17-5-3-2-4-14(17)8-9-18(20)19(15)10-13/h2-11,21H,12H2,1H3 |
| InChIKey | CURGXFJWGBZQTC-UHFFFAOYSA-N |
| Molecular Weight | 272.347 g/mol |
| SMILES | OCc1c2c(c3c(c1)ccc(c3)C)ccc1ccccc21 |
| SPLASH | splash10-00di-0090000000-dc322ad768d3e7776390 |
| Source of Spectrum | CRT-5-238-13 |
| Wiley ID | 1709258 |