| SpectraBase Compound ID | 3Y2KuChKoVk |
|---|---|
| InChI | InChI=1S/C12H11NO3S/c14-13(15)9-12(11-7-4-8-16-11)17-10-5-2-1-3-6-10/h1-8,12H,9H2 |
| InChIKey | IFQFWKPCXCOLJJ-UHFFFAOYSA-N |
| Mol Weight | 249.28 g/mol |
| Molecular Formula | C12H11NO3S |
| Exact Mass | 249.045964 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EnAgBzciq8B |
|---|---|
| Name | 2-(2-Nitro-1-(phenylthio)ethyl)furan |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H11NO3S |
| InChI | InChI=1S/C12H11NO3S/c14-13(15)9-12(11-7-4-8-16-11)17-10-5-2-1-3-6-10/h1-8,12H,9H2 |
| InChIKey | IFQFWKPCXCOLJJ-UHFFFAOYSA-N |
| Molecular Weight | 249.284 g/mol |
| SMILES | C(N(=O)=O)C(c1occc1)Sc1ccccc1 |
| SPLASH | splash10-05mo-9410000000-4114a9b9c22346f753ba |
| Source of Spectrum | F-65-3881-3ga |
| Wiley ID | 1680786 |