| SpectraBase Compound ID | FwsFf7AkuIE |
|---|---|
| InChI | InChI=1S/C9H17NO3/c1-7(2)6-10-8(11)4-3-5-9(12)13/h7H,3-6H2,1-2H3,(H,10,11)(H,12,13) |
| InChIKey | IRBQUWHUOVDRPR-UHFFFAOYSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C9H17NO3 |
| Exact Mass | 187.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JzIkfrps93D |
|---|---|
| Name | 5-(Isobutylamino)-5-oxopentanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.120843408 u |
| Formula | C9H17NO3 |
| InChI | InChI=1S/C9H17NO3/c1-7(2)6-10-8(11)4-3-5-9(12)13/h7H,3-6H2,1-2H3,(H,10,11)(H,12,13) |
| InChIKey | IRBQUWHUOVDRPR-UHFFFAOYSA-N |
| Molecular Weight | 187.239 g/mol |
| SMILES | N(C(CCCC(=O)O)=O)CC(C)C |