![3-(2-Nitro-1-phenylethyl)benzo[b]thiophene](/api/spectrum/H8wJLC51Zsy/structure.png?h=300&w=458 "3-(2-Nitro-1-phenylethyl)benzo[b]thiophene")
| SpectraBase Compound ID | BwDSxxzR04F |
|---|---|
| InChI | InChI=1S/C16H13NO2S/c18-17(19)10-14(12-6-2-1-3-7-12)15-11-20-16-9-5-4-8-13(15)16/h1-9,11,14H,10H2 |
| InChIKey | ICCKPPVZCGKRJP-UHFFFAOYSA-N |
| Mol Weight | 283.35 g/mol |
| Molecular Formula | C16H13NO2S |
| Exact Mass | 283.0667 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | H8wJLC51Zsy |
|---|---|
| Name | 3-(2-Nitro-1-phenylethyl)benzo[b]thiophene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H13NO2S |
| InChI | InChI=1S/C16H13NO2S/c18-17(19)10-14(12-6-2-1-3-7-12)15-11-20-16-9-5-4-8-13(15)16/h1-9,11,14H,10H2 |
| InChIKey | ICCKPPVZCGKRJP-UHFFFAOYSA-N |
| Molecular Weight | 283.345 g/mol |
| SMILES | c1(csc2c1cccc2)C(CN(=O)=O)c1ccccc1 |
| SPLASH | splash10-004i-1090000000-bf3f012a42db5d7b1f6e |
| Source of Spectrum | F-65-2640-2l |
| Wiley ID | 1682033 |