![Acetamide, N-[4-cyano-1-[[(4-methylphenyl)thio]methyl]butyl]-](/api/spectrum/AZuEC1hFZez/structure.png?h=300&w=458 "Acetamide, N-[4-cyano-1-[[(4-methylphenyl)thio]methyl]butyl]-")
| SpectraBase Compound ID | 75ldGOzuG9C |
|---|---|
| InChI | InChI=1S/C15H20N2OS/c1-12-6-8-15(9-7-12)19-11-14(17-13(2)18)5-3-4-10-16/h6-9,14H,3-5,11H2,1-2H3,(H,17,18) |
| InChIKey | FANVLQMWIFFCGY-UHFFFAOYSA-N |
| Mol Weight | 276.4 g/mol |
| Molecular Formula | C15H20N2OS |
| Exact Mass | 276.129634 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AZuEC1hFZez |
|---|---|
| Name | Acetamide, N-[4-cyano-1-[[(4-methylphenyl)thio]methyl]butyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.129634445 u |
| Formula | C15H20N2OS |
| InChI | InChI=1S/C15H20N2OS/c1-12-6-8-15(9-7-12)19-11-14(17-13(2)18)5-3-4-10-16/h6-9,14H,3-5,11H2,1-2H3,(H,17,18) |
| InChIKey | FANVLQMWIFFCGY-UHFFFAOYSA-N |
| Molecular Weight | 276.398 g/mol |
| SMILES | C(#N)CCCC(NC(=O)C)CSC1=CC=C(C=C1)C |