| SpectraBase Compound ID | LQIVqjYc5Zj |
|---|---|
| InChI | InChI=1S/C15H31NO/c1-5-8-10-11-14(4)16(13-7-3)15(17)12-9-6-2/h14H,5-13H2,1-4H3 |
| InChIKey | HLPXYTUPQKCZEU-UHFFFAOYSA-N |
| Mol Weight | 241.42 g/mol |
| Molecular Formula | C15H31NO |
| Exact Mass | 241.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3MAILrxFX8d |
|---|---|
| Name | Valeramide, N-propyl-N-(hept-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.240564621 u |
| Formula | C15H31NO |
| InChI | InChI=1S/C15H31NO/c1-5-8-10-11-14(4)16(13-7-3)15(17)12-9-6-2/h14H,5-13H2,1-4H3 |
| InChIKey | HLPXYTUPQKCZEU-UHFFFAOYSA-N |
| Molecular Weight | 241.419 g/mol |
| SMILES | C(=O)(N(CCC)C(CCCCC)C)CCCC |