| SpectraBase Compound ID | CsG9VIwE2x8 |
|---|---|
| InChI | InChI=1S/C16H24N2O2/c1-4-8-15(19)18-14(11-12(2)3)16(20)17-13-9-6-5-7-10-13/h5-7,9-10,12,14H,4,8,11H2,1-3H3,(H,17,20)(H,18,19) |
| InChIKey | YCOGQIPXMBLGKG-UHFFFAOYSA-N |
| Mol Weight | 276.38 g/mol |
| Molecular Formula | C16H24N2O2 |
| Exact Mass | 276.183778 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3i5FdydvNeS |
|---|---|
| Name | N-Butyryl-L-leucine anilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.183778019 u |
| Formula | C16H24N2O2 |
| InChI | InChI=1S/C16H24N2O2/c1-4-8-15(19)18-14(11-12(2)3)16(20)17-13-9-6-5-7-10-13/h5-7,9-10,12,14H,4,8,11H2,1-3H3,(H,17,20)(H,18,19) |
| InChIKey | YCOGQIPXMBLGKG-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC=C1)NC(=O)C(NC(CCC)=O)CC(C)C |