| SpectraBase Compound ID | 4tFDaIgVFTb |
|---|---|
| InChI | InChI=1S/C12H25NO3/c1-5-7-13(8-6-11(2)3)12(14)16-10-9-15-4/h11H,5-10H2,1-4H3 |
| InChIKey | QELBAAFJADIFLX-UHFFFAOYSA-N |
| Mol Weight | 231.34 g/mol |
| Molecular Formula | C12H25NO3 |
| Exact Mass | 231.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6cbriRU8o26 |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, 2-methoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.183443666 u |
| Formula | C12H25NO3 |
| InChI | InChI=1S/C12H25NO3/c1-5-7-13(8-6-11(2)3)12(14)16-10-9-15-4/h11H,5-10H2,1-4H3 |
| InChIKey | QELBAAFJADIFLX-UHFFFAOYSA-N |
| Molecular Weight | 231.336 g/mol |
| SMILES | C(N(CCC)CCC(C)C)(=O)OCCOC |