| SpectraBase Compound ID | 1iFoqRdud3P |
|---|---|
| InChI | InChI=1S/C17H25NO3/c1-4-14-8-5-6-9-15(14)18-16(19)10-7-11-17(20)21-12-13(2)3/h5-6,8-9,13H,4,7,10-12H2,1-3H3,(H,18,19) |
| InChIKey | BYKFCTOFSUQGEE-UHFFFAOYSA-N |
| Mol Weight | 291.39 g/mol |
| Molecular Formula | C17H25NO3 |
| Exact Mass | 291.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8HdGCcFkr1f |
|---|---|
| Name | Glutaric acid, monoamide, N-(2-ethylphenyl)-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.183443666 u |
| Formula | C17H25NO3 |
| InChI | InChI=1S/C17H25NO3/c1-4-14-8-5-6-9-15(14)18-16(19)10-7-11-17(20)21-12-13(2)3/h5-6,8-9,13H,4,7,10-12H2,1-3H3,(H,18,19) |
| InChIKey | BYKFCTOFSUQGEE-UHFFFAOYSA-N |
| SMILES | C1=CC=C(C(=C1)NC(CCCC(OCC(C)C)=O)=O)CC |