![2-[2'-Nitro-1'-(thiophen-2"-yl))ethyl]cyclohexanone](/api/spectrum/CNiN0iXZ7Mr/structure.png?h=300&w=458 "2-[2'-Nitro-1'-(thiophen-2\"-yl))ethyl]cyclohexanone")
| SpectraBase Compound ID | 3N7HhbvQdv2 |
|---|---|
| InChI | InChI=1S/C12H15NO3S/c14-11-5-2-1-4-9(11)10(8-13(15)16)12-6-3-7-17-12/h3,6-7,9-10H,1-2,4-5,8H2 |
| InChIKey | IXTLLOSYBIWABX-UHFFFAOYSA-N |
| Mol Weight | 253.32 g/mol |
| Molecular Formula | C12H15NO3S |
| Exact Mass | 253.077265 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CNiN0iXZ7Mr |
|---|---|
| Name | 2-[2'-Nitro-1'-(thiophen-2"-yl))ethyl]cyclohexanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15NO3S |
| InChI | InChI=1S/C12H15NO3S/c14-11-5-2-1-4-9(11)10(8-13(15)16)12-6-3-7-17-12/h3,6-7,9-10H,1-2,4-5,8H2 |
| InChIKey | IXTLLOSYBIWABX-UHFFFAOYSA-N |
| Molecular Weight | 253.316 g/mol |
| SMILES | C(N(=O)=O)C(c1sccc1)C1C(=O)CCCC1 |
| SPLASH | splash10-06vi-1950000000-bafb3383a13fe551d6d8 |
| Source of Spectrum | H-82-1838-1 |
| Wiley ID | 815686 |