| SpectraBase Compound ID | mI4D4W70iH |
|---|---|
| InChI | InChI=1S/C27H55NO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-28(26(4)7-3)27(29)24-9-6-2/h26H,5-25H2,1-4H3 |
| InChIKey | KNSDEYRGKXOMRM-UHFFFAOYSA-N |
| Mol Weight | 409.7 g/mol |
| Molecular Formula | C27H55NO |
| Exact Mass | 409.428365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KWfr8WVhzBF |
|---|---|
| Name | Valeramide, N-(2-butyl)-N-octadecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 409.428365394 u |
| Formula | C27H55NO |
| InChI | InChI=1S/C27H55NO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-28(26(4)7-3)27(29)24-9-6-2/h26H,5-25H2,1-4H3 |
| InChIKey | KNSDEYRGKXOMRM-UHFFFAOYSA-N |
| Molecular Weight | 409.743 g/mol |
| SMILES | C(=O)(N(CCCCCCCCCCCCCCCCCC)C(CC)C)CCCC |