| SpectraBase Compound ID | IeIzMZIs6H2 |
|---|---|
| InChI | InChI=1S/C26H45NOS/c1-3-5-7-9-11-13-18-22-27(23-19-14-12-10-8-6-4-2)26(28)24-29-25-20-16-15-17-21-25/h15-17,20-21H,3-14,18-19,22-24H2,1-2H3 |
| InChIKey | UVWOPRXNFHKUBZ-UHFFFAOYSA-N |
| Mol Weight | 419.7 g/mol |
| Molecular Formula | C26H45NOS |
| Exact Mass | 419.322186 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AmOktCjDBtg |
|---|---|
| Name | Phenylthioacetamide, N,N-dinonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 419.322186246 u |
| Formula | C26H45NOS |
| InChI | InChI=1S/C26H45NOS/c1-3-5-7-9-11-13-18-22-27(23-19-14-12-10-8-6-4-2)26(28)24-29-25-20-16-15-17-21-25/h15-17,20-21H,3-14,18-19,22-24H2,1-2H3 |
| InChIKey | UVWOPRXNFHKUBZ-UHFFFAOYSA-N |
| Molecular Weight | 419.712 g/mol |
| SMILES | C1=CC=CC(=C1)SCC(N(CCCCCCCCC)CCCCCCCCC)=O |