![4-[(4,6-Dimethyl-2-pyrimidinyl)amino]butanoic acid](/api/spectrum/A5F5JxhnLpk/structure.png?h=300&w=458 "4-[(4,6-Dimethyl-2-pyrimidinyl)amino]butanoic acid")
| SpectraBase Compound ID | D1CaVPOl6hj |
|---|---|
| InChI | InChI=1S/C10H15N3O2/c1-7-6-8(2)13-10(12-7)11-5-3-4-9(14)15/h6H,3-5H2,1-2H3,(H,14,15)(H,11,12,13) |
| InChIKey | BVTPAQUYSVYQDA-UHFFFAOYSA-N |
| Mol Weight | 209.25 g/mol |
| Molecular Formula | C10H15N3O2 |
| Exact Mass | 209.116427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A5F5JxhnLpk |
|---|---|
| Name | 4-[(4,6-Dimethyl-2-pyrimidinyl)amino]butanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.116426733 u |
| Formula | C10H15N3O2 |
| InChI | InChI=1S/C10H15N3O2/c1-7-6-8(2)13-10(12-7)11-5-3-4-9(14)15/h6H,3-5H2,1-2H3,(H,14,15)(H,11,12,13) |
| InChIKey | BVTPAQUYSVYQDA-UHFFFAOYSA-N |
| Molecular Weight | 209.249 g/mol |
| SMILES | CC1=NC(=NC(C)=C1)NCCCC(O)=O |