| SpectraBase Compound ID | 26wNLBLuFSL |
|---|---|
| InChI | InChI=1S/C16H18N2O4/c1-17-5-7-18(8-6-17)15(19)13-10-11-9-12(21-2)3-4-14(11)22-16(13)20/h3-4,9-10H,5-8H2,1-2H3 |
| InChIKey | CXAFKWCZNCUCSD-UHFFFAOYSA-N |
| Mol Weight | 302.33 g/mol |
| Molecular Formula | C16H18N2O4 |
| Exact Mass | 302.126657 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2egGvdPldfM |
|---|---|
| Name | 6-Methoxy-3-(4-methylpiperazine-1-carbonyl)-chromen-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.126657064 u |
| Formula | C16H18N2O4 |
| InChI | InChI=1S/C16H18N2O4/c1-17-5-7-18(8-6-17)15(19)13-10-11-9-12(21-2)3-4-14(11)22-16(13)20/h3-4,9-10H,5-8H2,1-2H3 |
| InChIKey | CXAFKWCZNCUCSD-UHFFFAOYSA-N |
| Molecular Weight | 302.330 g/mol |
| SMILES | C1N(CCN(C1)C)C(C1=CC2=CC(=CC=C2OC1=O)OC)=O |