| SpectraBase Compound ID | 7gQl2eJqWwR |
|---|---|
| InChI | InChI=1S/C21H16/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-9,12H,10-11H2,1H3 |
| InChIKey | PPQNQXQZIWHJRB-UHFFFAOYSA-N |
| Mol Weight | 268.36 g/mol |
| Molecular Formula | C21H16 |
| Exact Mass | 268.125201 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1H13jDOHhvn |
|---|---|
| Name | 3-Methylcholanthrene |
| Catalog Number | 213942 |
| Brand | SIGMA |
| CAS Registry Number | 56-49-5 |
| Copyright | Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H16 |
| Formula (reported) | C21H16 |
| InChI | InChI=1S/C21H16/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-9,12H,10-11H2,1H3 |
| InChIKey | PPQNQXQZIWHJRB-UHFFFAOYSA-N |
| Purity | 98% |
| Wiley ID | SIAL_RAMAN_004664 |