| SpectraBase Compound ID | 1qCYdnkTJ3E |
|---|---|
| InChI | InChI=1S/C22H22ClNO2/c1-25-21-7-3-5-17(13-21)15-24(20-11-9-19(23)10-12-20)16-18-6-4-8-22(14-18)26-2/h3-14H,15-16H2,1-2H3 |
| InChIKey | QULLADGFVOQKLI-UHFFFAOYSA-N |
| Mol Weight | 367.88 g/mol |
| Molecular Formula | C22H22ClNO2 |
| Exact Mass | 367.133907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LXQNcISyOOn |
|---|---|
| Name | N,N-bis-(3-Methoxybenzyl)-4-chloroaniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 367.133906650 u |
| Formula | C22H22ClNO2 |
| InChI | InChI=1S/C22H22ClNO2/c1-25-21-7-3-5-17(13-21)15-24(20-11-9-19(23)10-12-20)16-18-6-4-8-22(14-18)26-2/h3-14H,15-16H2,1-2H3 |
| InChIKey | QULLADGFVOQKLI-UHFFFAOYSA-N |
| Molecular Weight | 367.876 g/mol |
| SMILES | C1(N(CC2=CC(=CC=C2)OC)CC2=CC(=CC=C2)OC)=CC=C(C=C1)Cl |