| SpectraBase Compound ID | JVk6mkGrfKJ |
|---|---|
| InChI | InChI=1S/C14H20N2O2/c1-4-5-10-18-14(17)12-6-8-13(9-7-12)15-11-16(2)3/h6-9,11H,4-5,10H2,1-3H3/b15-11+ |
| InChIKey | JKAOJALVXDWRQI-RVDMUPIBSA-N |
| Mol Weight | 248.33 g/mol |
| Molecular Formula | C14H20N2O2 |
| Exact Mass | 248.152478 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2VnXe1K1aDd |
|---|---|
| Name | 4-Aminobenzoic acid, N-dimethylaminomethylene-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.152477890 u |
| Formula | C14H20N2O2 |
| InChI | InChI=1S/C14H20N2O2/c1-4-5-10-18-14(17)12-6-8-13(9-7-12)15-11-16(2)3/h6-9,11H,4-5,10H2,1-3H3/b15-11+ |
| InChIKey | JKAOJALVXDWRQI-RVDMUPIBSA-N |
| Molecular Weight | 248.326 g/mol |
| SMILES | C1=CC(=CC=C1C(OCCCC)=O)\N=C\N(C)C |