| SpectraBase Compound ID | GfHoJVNOY8m |
|---|---|
| InChI | InChI=1S/C30H53NO/c1-7-8-9-10-21(2)19-23-12-14-27-26-13-11-24-20-25(31(6)22(3)32)15-17-29(24,4)28(26)16-18-30(23,27)5/h21,23-28H,7-20H2,1-6H3/t21?,23?,24?,25?,26-,27-,28-,29-,30+/m0/s1 |
| InChIKey | PRJAEHYFQFAAKZ-BXJPAZADSA-N |
| Mol Weight | 443.8 g/mol |
| Molecular Formula | C30H53NO |
| Exact Mass | 443.412715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9V7j4xi9AR0 |
|---|---|
| Name | Acetamide, N-cholestan-3-yl-N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 443.412715330 u |
| Formula | C30H53NO |
| InChI | InChI=1S/C30H53NO/c1-7-8-9-10-21(2)19-23-12-14-27-26-13-11-24-20-25(31(6)22(3)32)15-17-29(24,4)28(26)16-18-30(23,27)5/h21,23-28H,7-20H2,1-6H3/t21?,23?,24?,25?,26-,27-,28-,29-,30+/m0/s1 |
| InChIKey | PRJAEHYFQFAAKZ-BXJPAZADSA-N |
| Molecular Weight | 443.760 g/mol |
| SMILES | [C@@]12([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)CC(CCCCC)C)[H])([H])CCC2CC(N(C(=O)C)C)CC1)[H])C |