| SpectraBase Compound ID | HnjPiYej0CT |
|---|---|
| InChI | InChI=1S/C21H29NOS/c1-2-3-4-5-9-15-22(16-14-19-11-7-6-8-12-19)21(23)18-20-13-10-17-24-20/h6-8,10-13,17H,2-5,9,14-16,18H2,1H3 |
| InChIKey | GIHWTMJALQSQQC-UHFFFAOYSA-N |
| Mol Weight | 343.53 g/mol |
| Molecular Formula | C21H29NOS |
| Exact Mass | 343.196986 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DfzMWO56Ag1 |
|---|---|
| Name | Thiophene-2-acetamide, N-(2-phenylethyl)-N-heptyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.196985731 u |
| Formula | C21H29NOS |
| InChI | InChI=1S/C21H29NOS/c1-2-3-4-5-9-15-22(16-14-19-11-7-6-8-12-19)21(23)18-20-13-10-17-24-20/h6-8,10-13,17H,2-5,9,14-16,18H2,1H3 |
| InChIKey | GIHWTMJALQSQQC-UHFFFAOYSA-N |
| Molecular Weight | 343.529 g/mol |
| SMILES | C1=CC=C(C=C1)CCN(C(CC=1SC=CC1)=O)CCCCCCC |