| SpectraBase Compound ID | Lvw2ba6TXgr |
|---|---|
| InChI | InChI=1S/C14H22BrNO2/c1-6-11(16(2)3)7-10-8-13(17-4)14(18-5)9-12(10)15/h8-9,11H,6-7H2,1-5H3 |
| InChIKey | UCIVCUQIZVFGGX-UHFFFAOYSA-N |
| Mol Weight | 316.24 g/mol |
| Molecular Formula | C14H22BrNO2 |
| Exact Mass | 315.083392 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 22xc3grTKBc |
|---|---|
| Name | N,N-Dimethyl-1-(2-bromo-4,5-dimethoxyphenyl)butan-2-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.083391950 u |
| Formula | C14H22BrNO2 |
| InChI | InChI=1S/C14H22BrNO2/c1-6-11(16(2)3)7-10-8-13(17-4)14(18-5)9-12(10)15/h8-9,11H,6-7H2,1-5H3 |
| InChIKey | UCIVCUQIZVFGGX-UHFFFAOYSA-N |
| Molecular Weight | 316.239 g/mol |
| SMILES | C=1(C(=CC(=C(C1)OC)OC)Br)CC(N(C)C)CC |