| SpectraBase Compound ID | 7KYA9m41UgJ |
|---|---|
| InChI | InChI=1S/C16H9NO2/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H |
| InChIKey | ALRLPDGCPYIVHP-UHFFFAOYSA-N |
| Mol Weight | 247.25 g/mol |
| Molecular Formula | C16H9NO2 |
| Exact Mass | 247.063329 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 49U8mmmbMRt |
|---|---|
| Name | 1-NITROPYRENE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H9NO2 |
| InChI | InChI=1S/C16H9NO2/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H |
| InChIKey | ALRLPDGCPYIVHP-UHFFFAOYSA-N |
| Molecular Weight | 247.0631 |
| SMILES | c1cc2c3c4c(c(N(=O)=O)ccc4cc2)ccc3c1 |
| SPLASH | splash10-0udi-0490000000-a31dc3f6e59c82a766c1 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |