| SpectraBase Compound ID | 8NpgBCXXpXm |
|---|---|
| InChI | InChI=1S/C17H26N2O3/c1-5-6-11-19(14(2)20)16-9-7-15(8-10-16)17(21)22-13-12-18(3)4/h7-10H,5-6,11-13H2,1-4H3 |
| InChIKey | MJDWBSFEMSGKCQ-UHFFFAOYSA-N |
| Mol Weight | 306.41 g/mol |
| Molecular Formula | C17H26N2O3 |
| Exact Mass | 306.194343 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GKemhQdBN9R |
|---|---|
| Name | 2-(Dimethylamino)ethyl 4-(N-butylacetamido)benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.194342702 u |
| Formula | C17H26N2O3 |
| InChI | InChI=1S/C17H26N2O3/c1-5-6-11-19(14(2)20)16-9-7-15(8-10-16)17(21)22-13-12-18(3)4/h7-10H,5-6,11-13H2,1-4H3 |
| InChIKey | MJDWBSFEMSGKCQ-UHFFFAOYSA-N |
| Molecular Weight | 306.406 g/mol |
| SMILES | C1=C(C=CC(=C1)N(CCCC)C(C)=O)C(OCCN(C)C)=O |