| SpectraBase Compound ID | HEEAN3FIgmh |
|---|---|
| InChI | InChI=1S/C14H20N2O4/c1-9(17)7-15-13(19)11-3-5-12(6-4-11)14(20)16-8-10(2)18/h3-6,9-10,17-18H,7-8H2,1-2H3,(H,15,19)(H,16,20) |
| InChIKey | ROHSLYYOPPECMM-UHFFFAOYSA-N |
| Mol Weight | 280.32 g/mol |
| Molecular Formula | C14H20N2O4 |
| Exact Mass | 280.142307 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E5ipoGaaNTY |
|---|---|
| Name | Terephthalamide-N,N'-diisopropanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.142307128 u |
| Formula | C14H20N2O4 |
| InChI | InChI=1S/C14H20N2O4/c1-9(17)7-15-13(19)11-3-5-12(6-4-11)14(20)16-8-10(2)18/h3-6,9-10,17-18H,7-8H2,1-2H3,(H,15,19)(H,16,20) |
| InChIKey | ROHSLYYOPPECMM-UHFFFAOYSA-N |
| SMILES | C(NC(=O)C1=CC=C(C(NCC(O)C)=O)C=C1)C(O)C |