| SpectraBase Compound ID | BEL4pFp87TI |
|---|---|
| InChI | InChI=1S/C16H25NO/c1-4-6-7-14(5-2)12-17-16(18)15-10-8-13(3)9-11-15/h8-11,14H,4-7,12H2,1-3H3,(H,17,18) |
| InChIKey | IZWFAWINODGLHJ-UHFFFAOYSA-N |
| Mol Weight | 247.38 g/mol |
| Molecular Formula | C16H25NO |
| Exact Mass | 247.193614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I1gUjP934oP |
|---|---|
| Name | Benzamide, 4-methyl-N-(2-ethylhexyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.193614428 u |
| Formula | C16H25NO |
| InChI | InChI=1S/C16H25NO/c1-4-6-7-14(5-2)12-17-16(18)15-10-8-13(3)9-11-15/h8-11,14H,4-7,12H2,1-3H3,(H,17,18) |
| InChIKey | IZWFAWINODGLHJ-UHFFFAOYSA-N |
| Molecular Weight | 247.382 g/mol |
| SMILES | C(NCC(CCCC)CC)(=O)C=1C=CC(=CC1)C |