| SpectraBase Compound ID | 86m3VqCJf34 |
|---|---|
| InChI | InChI=1S/C12H16N2O3/c1-9(15)13-7-8-14-12(16)10-3-5-11(17-2)6-4-10/h3-6H,7-8H2,1-2H3,(H,13,15)(H,14,16) |
| InChIKey | RLRWKYMRGAIKIB-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C12H16N2O3 |
| Exact Mass | 236.116092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dic5qem4ji2 |
|---|---|
| Name | Meop-m (N,N-bisdealkyl-nor-) ac P539 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.116092380 u |
| Formula | C12H16N2O3 |
| InChI | InChI=1S/C12H16N2O3/c1-9(15)13-7-8-14-12(16)10-3-5-11(17-2)6-4-10/h3-6H,7-8H2,1-2H3,(H,13,15)(H,14,16) |
| InChIKey | RLRWKYMRGAIKIB-UHFFFAOYSA-N |
| Molecular Weight | 236.271 g/mol |
| SMILES | C=1(C=CC(=CC1)OC)C(NCCNC(=O)C)=O |