| SpectraBase Compound ID | AfCpBrBpwOb |
|---|---|
| InChI | InChI=1S/C9H12IN/c1-11(2)7-8-4-3-5-9(10)6-8/h3-6H,7H2,1-2H3 |
| InChIKey | WYNJGHRFIPXFMC-UHFFFAOYSA-N |
| Mol Weight | 261.11 g/mol |
| Molecular Formula | C9H12IN |
| Exact Mass | 261.001444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KjfFPwXUZ1C |
|---|---|
| Name | N,N-Dimethyl-(3-iodobenzyl)amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.001444390 u |
| Formula | C9H12IN |
| InChI | InChI=1S/C9H12IN/c1-11(2)7-8-4-3-5-9(10)6-8/h3-6H,7H2,1-2H3 |
| InChIKey | WYNJGHRFIPXFMC-UHFFFAOYSA-N |
| Molecular Weight | 261.106 g/mol |
| SMILES | C=1(C=C(C=CC1)I)CN(C)C |