| SpectraBase Compound ID | GwEkQDctikz |
|---|---|
| InChI | InChI=1S/C18H28BrNO/c1-4-6-8-10-15(3)20(13-7-5-2)18(21)16-11-9-12-17(19)14-16/h9,11-12,14-15H,4-8,10,13H2,1-3H3 |
| InChIKey | WGMKDCCHRKALCD-UHFFFAOYSA-N |
| Mol Weight | 354.33 g/mol |
| Molecular Formula | C18H28BrNO |
| Exact Mass | 353.135428 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1jOVyqBVHGi |
|---|---|
| Name | Benzamide, 3-bromo-N-butyl-N-hept-2-yl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.135427525 u |
| Formula | C18H28BrNO |
| InChI | InChI=1S/C18H28BrNO/c1-4-6-8-10-15(3)20(13-7-5-2)18(21)16-11-9-12-17(19)14-16/h9,11-12,14-15H,4-8,10,13H2,1-3H3 |
| InChIKey | WGMKDCCHRKALCD-UHFFFAOYSA-N |
| Molecular Weight | 354.332 g/mol |
| SMILES | C1=C(C=CC=C1Br)C(N(C(CCCCC)C)CCCC)=O |