| SpectraBase Compound ID | 1epqa1tUpxI |
|---|---|
| InChI | InChI=1S/C22H37NO/c1-5-8-9-10-11-12-13-18-23(19(4)6-2)22(24)21-16-14-20(7-3)15-17-21/h14-17,19H,5-13,18H2,1-4H3 |
| InChIKey | GSHMMIXKFWNJFU-UHFFFAOYSA-N |
| Mol Weight | 331.5 g/mol |
| Molecular Formula | C22H37NO |
| Exact Mass | 331.287515 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2vspSfbad42 |
|---|---|
| Name | Benzamide, 4-ethyl-N-(2-butyl)-N-nonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.287514814 u |
| Formula | C22H37NO |
| InChI | InChI=1S/C22H37NO/c1-5-8-9-10-11-12-13-18-23(19(4)6-2)22(24)21-16-14-20(7-3)15-17-21/h14-17,19H,5-13,18H2,1-4H3 |
| InChIKey | GSHMMIXKFWNJFU-UHFFFAOYSA-N |
| Molecular Weight | 331.544 g/mol |
| SMILES | C(N(CCCCCCCCC)C(CC)C)(=O)C=1C=CC(=CC1)CC |