| SpectraBase Compound ID | 836lNhrjOeR |
|---|---|
| InChI | InChI=1S/C13H13NO2S/c1-10-7-8-13(17-10)12(9-14(15)16)11-5-3-2-4-6-11/h2-8,12H,9H2,1H3 |
| InChIKey | DSGNUWXTVUQREC-UHFFFAOYSA-N |
| Mol Weight | 247.31 g/mol |
| Molecular Formula | C13H13NO2S |
| Exact Mass | 247.0667 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5TFI834keMo |
|---|---|
| Name | 2-Methyl-5-(2-nitro-1-phenylethyl)thiophene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H13NO2S |
| InChI | InChI=1S/C13H13NO2S/c1-10-7-8-13(17-10)12(9-14(15)16)11-5-3-2-4-6-11/h2-8,12H,9H2,1H3 |
| InChIKey | DSGNUWXTVUQREC-UHFFFAOYSA-N |
| Molecular Weight | 247.312 g/mol |
| SMILES | c1(sc(C)cc1)C(CN(=O)=O)c1ccccc1 |
| SPLASH | splash10-000t-0910000000-be14f9c0ff261b7982cf |
| Source of Spectrum | F-65-2640-2k |
| Wiley ID | 1682034 |