| SpectraBase Compound ID | 4B9iDbwvL9s |
|---|---|
| InChI | InChI=1S/C14H20BrNO3/c1-5-14(17)16-9(2)6-10-7-12(18-3)13(19-4)8-11(10)15/h7-9H,5-6H2,1-4H3,(H,16,17) |
| InChIKey | VFLDPIITTPSRLZ-UHFFFAOYSA-N |
| Mol Weight | 330.22 g/mol |
| Molecular Formula | C14H20BrNO3 |
| Exact Mass | 329.062657 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Di1xzm4Z12F |
|---|---|
| Name | 2-Bromo-4,5-dimethoxyamphetamine prop |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.062656505 u |
| Formula | C14H20BrNO3 |
| InChI | InChI=1S/C14H20BrNO3/c1-5-14(17)16-9(2)6-10-7-12(18-3)13(19-4)8-11(10)15/h7-9H,5-6H2,1-4H3,(H,16,17) |
| InChIKey | VFLDPIITTPSRLZ-UHFFFAOYSA-N |
| Molecular Weight | 330.222 g/mol |
| SMILES | C=1(C(=CC(=C(C1)OC)OC)Br)CC(NC(CC)=O)C |