![2-Nitrobenzo[a]pyrene](/api/spectrum/5ZHNXsMUW1H/structure.png?h=300&w=458 "2-Nitrobenzo[a]pyrene")
| SpectraBase Compound ID | H1KkaclSwng |
|---|---|
| InChI | InChI=1S/C20H11NO2/c22-21(23)16-10-14-6-5-13-9-12-3-1-2-4-17(12)18-8-7-15(11-16)19(14)20(13)18/h1-11H |
| InChIKey | GYEJGVYFCBTODU-UHFFFAOYSA-N |
| Mol Weight | 297.31 g/mol |
| Molecular Formula | C20H11NO2 |
| Exact Mass | 297.078979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5ZHNXsMUW1H |
|---|---|
| Name | 2-Nitrobenzo[a]pyrene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H11NO2 |
| InChI | InChI=1S/C20H11NO2/c22-21(23)16-10-14-6-5-13-9-12-3-1-2-4-17(12)18-8-7-15(11-16)19(14)20(13)18/h1-11H |
| InChIKey | GYEJGVYFCBTODU-UHFFFAOYSA-N |
| Molecular Weight | 297.313 g/mol |
| SMILES | c12c3c4c(cccc4)cc1ccc1c2c(cc(N(=O)=O)c1)cc3 |
| SPLASH | splash10-0udi-0090000000-07a57a881ee4053e8fc5 |
| Source of Spectrum | J-61-5273-16 |
| Wiley ID | 1300358 |