| SpectraBase Compound ID | 2dOQJP6HwFY |
|---|---|
| InChI | InChI=1S/C18H26BrNO2/c1-3-5-7-13-17(21)20(18(22)14-8-6-4-2)16-12-10-9-11-15(16)19/h9-12H,3-8,13-14H2,1-2H3 |
| InChIKey | FXZNPZGOZKTEOY-UHFFFAOYSA-N |
| Mol Weight | 368.32 g/mol |
| Molecular Formula | C18H26BrNO2 |
| Exact Mass | 367.114692 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ImcwxDCnSh |
|---|---|
| Name | Hexanamide, N-hexanoyl-N-(2-bromophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 367.114692079 u |
| Formula | C18H26BrNO2 |
| InChI | InChI=1S/C18H26BrNO2/c1-3-5-7-13-17(21)20(18(22)14-8-6-4-2)16-12-10-9-11-15(16)19/h9-12H,3-8,13-14H2,1-2H3 |
| InChIKey | FXZNPZGOZKTEOY-UHFFFAOYSA-N |
| Molecular Weight | 368.315 g/mol |
| SMILES | C1(=C(C=CC=C1)Br)N(C(CCCCC)=O)C(=O)CCCCC |