| SpectraBase Compound ID | 4GGC1mDduBZ |
|---|---|
| InChI | InChI=1S/C27H46BrNO/c1-3-5-7-9-11-13-15-17-22-29(23-18-16-14-12-10-8-6-4-2)27(30)25-20-19-21-26(28)24-25/h19-21,24H,3-18,22-23H2,1-2H3 |
| InChIKey | WXMVNEJSALHXED-UHFFFAOYSA-N |
| Mol Weight | 480.6 g/mol |
| Molecular Formula | C27H46BrNO |
| Exact Mass | 479.276278 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ChZkbqjHCP5 |
|---|---|
| Name | Benzamide, N,N-didecyl-3-bromo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 479.276278104 u |
| Formula | C27H46BrNO |
| InChI | InChI=1S/C27H46BrNO/c1-3-5-7-9-11-13-15-17-22-29(23-18-16-14-12-10-8-6-4-2)27(30)25-20-19-21-26(28)24-25/h19-21,24H,3-18,22-23H2,1-2H3 |
| InChIKey | WXMVNEJSALHXED-UHFFFAOYSA-N |
| Molecular Weight | 480.575 g/mol |
| SMILES | C1(=CC=CC(=C1)C(N(CCCCCCCCCC)CCCCCCCCCC)=O)Br |