| SpectraBase Compound ID | 3M9t1J8rxwc |
|---|---|
| InChI | InChI=1S/C20H25NO6/c21-16-5-6-19-20(15-16)27-14-10-23-8-12-25-18-4-2-1-3-17(18)24-11-7-22-9-13-26-19/h1-6,15H,7-14,21H2 |
| InChIKey | FFYZYAKXQMHVQE-UHFFFAOYSA-N |
| Mol Weight | 375.42 g/mol |
| Molecular Formula | C20H25NO6 |
| Exact Mass | 375.168188 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5XMeSoobTAl |
|---|---|
| Name | 4-Aminodibenzo-18-crown-6 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 375.168187523 u |
| Formula | C20H25NO6 |
| InChI | InChI=1S/C20H25NO6/c21-16-5-6-19-20(15-16)27-14-10-23-8-12-25-18-4-2-1-3-17(18)24-11-7-22-9-13-26-19/h1-6,15H,7-14,21H2 |
| InChIKey | FFYZYAKXQMHVQE-UHFFFAOYSA-N |
| Molecular Weight | 375.421 g/mol |
| SMILES | C1OCCOC=2C=C(C=CC2OCCOCCOC2=C(OC1)C=CC=C2)N |