| SpectraBase Compound ID | 1tcNE9dtgIV |
|---|---|
| InChI | InChI=1S/C16H21N/c1-4-5-11-17-13(2)12-16(14(17)3)15-9-7-6-8-10-15/h6-10,12H,4-5,11H2,1-3H3 |
| InChIKey | VGPZDZRWEOKZMX-UHFFFAOYSA-N |
| Mol Weight | 227.35 g/mol |
| Molecular Formula | C16H21N |
| Exact Mass | 227.1674 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KJO16uuuYfj |
|---|---|
| Name | 1-Butyl-2,5-dimethyl-3-phenyl-pyrrole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H21N |
| InChI | InChI=1S/C16H21N/c1-4-5-11-17-13(2)12-16(14(17)3)15-9-7-6-8-10-15/h6-10,12H,4-5,11H2,1-3H3 |
| InChIKey | VGPZDZRWEOKZMX-UHFFFAOYSA-N |
| Molecular Weight | 227.351 g/mol |
| SMILES | c1(c([n](CCCC)c(c1)C)C)-c1ccccc1 |
| SPLASH | splash10-001i-0930000000-83b6f323c9788ea32099 |
| Source of Spectrum | J-63-6238-4 |
| Wiley ID | 1228934 |