| SpectraBase Compound ID | 9g0K3aGQcds |
|---|---|
| InChI | InChI=1S/C13H23NO2/c1-5-7-11-16-13(15)14(9-6-2)10-8-12(3)4/h12H,6,8-11H2,1-4H3 |
| InChIKey | AMNVDPGYSTXEPM-UHFFFAOYSA-N |
| Mol Weight | 225.33 g/mol |
| Molecular Formula | C13H23NO2 |
| Exact Mass | 225.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hhx32pWTIF5 |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, but-2-yn-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.172878983 u |
| Formula | C13H23NO2 |
| InChI | InChI=1S/C13H23NO2/c1-5-7-11-16-13(15)14(9-6-2)10-8-12(3)4/h12H,6,8-11H2,1-4H3 |
| InChIKey | AMNVDPGYSTXEPM-UHFFFAOYSA-N |
| Molecular Weight | 225.332 g/mol |
| SMILES | C(=O)(OCC#CC)N(CCC)CCC(C)C |