| SpectraBase Compound ID | JLfL2OuLa4H |
|---|---|
| InChI | InChI=1S/C13H16N2O4/c1-8(2)15-13(17)12(16)14-6-9-3-4-10-11(5-9)19-7-18-10/h3-5,8H,6-7H2,1-2H3,(H,14,16)(H,15,17) |
| InChIKey | NREXRMSUAPRLTF-UHFFFAOYSA-N |
| Mol Weight | 264.28 g/mol |
| Molecular Formula | C13H16N2O4 |
| Exact Mass | 264.111007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JfjGNDwYgOp |
|---|---|
| Name | N~1~-(1,3-Benzodioxol-5-ylmethyl)-N~2~-isopropylethanediamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.111006999 u |
| Formula | C13H16N2O4 |
| InChI | InChI=1S/C13H16N2O4/c1-8(2)15-13(17)12(16)14-6-9-3-4-10-11(5-9)19-7-18-10/h3-5,8H,6-7H2,1-2H3,(H,14,16)(H,15,17) |
| InChIKey | NREXRMSUAPRLTF-UHFFFAOYSA-N |
| Molecular Weight | 264.281 g/mol |
| SMILES | N(C(C(NC(C)C)=O)=O)CC1=CC=2OCOC2C=C1 |