| SpectraBase Compound ID | K1PcBbB5iDr |
|---|---|
| InChI | InChI=1S/C10H14IN/c1-8(12-2)7-9-3-5-10(11)6-4-9/h3-6,8,12H,7H2,1-2H3 |
| InChIKey | MXJYUKFIZBQAJV-UHFFFAOYSA-N |
| Mol Weight | 275.13 g/mol |
| Molecular Formula | C10H14IN |
| Exact Mass | 275.017094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | T4mM3F1JkU |
|---|---|
| Name | 4-Iodomethamphetamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.017094455 u |
| Formula | C10H14IN |
| InChI | InChI=1S/C10H14IN/c1-8(12-2)7-9-3-5-10(11)6-4-9/h3-6,8,12H,7H2,1-2H3 |
| InChIKey | MXJYUKFIZBQAJV-UHFFFAOYSA-N |
| Molecular Weight | 275.133 g/mol |
| SMILES | C(NC)(CC=1C=CC(=CC1)I)C |