| SpectraBase Compound ID | 4Len9y76rl4 |
|---|---|
| InChI | InChI=1S/C21H16O2/c1-13-7-8-15-12-19(21(22)23-2)20-16-6-4-3-5-14(16)9-10-17(20)18(15)11-13/h3-12H,1-2H3 |
| InChIKey | HEHONMXWXYFHMA-UHFFFAOYSA-N |
| Mol Weight | 300.36 g/mol |
| Molecular Formula | C21H16O2 |
| Exact Mass | 300.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2l85lojrBor |
|---|---|
| Name | 5-(Methoxycarbonyl)-9-methylchrysene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H16O2 |
| InChI | InChI=1S/C21H16O2/c1-13-7-8-15-12-19(21(22)23-2)20-16-6-4-3-5-14(16)9-10-17(20)18(15)11-13/h3-12H,1-2H3 |
| InChIKey | HEHONMXWXYFHMA-UHFFFAOYSA-N |
| Molecular Weight | 300.357 g/mol |
| SMILES | c12c(cc3c(c2ccc2c1cccc2)cc(cc3)C)C(=O)OC |
| SPLASH | splash10-0udi-0089000000-330f92af624421c9ee04 |
| Source of Spectrum | CRT-5-238-9 |
| Wiley ID | 1709273 |