![(Sp)-4-Bromo-N-(1-hydroxy-2-methyl-2-propyl)-[2.2]paracyclophane-12-carboxamide](/api/spectrum/9u5pP90gFhh/structure.png?h=300&w=458 "(Sp)-4-Bromo-N-(1-hydroxy-2-methyl-2-propyl)-[2.2]paracyclophane-12-carboxamide")
| SpectraBase Compound ID | 3chxOZc3Yvl |
|---|---|
| InChI | InChI=1S/C21H24BrNO2/c1-21(2,13-24)23-20(25)18-11-14-3-7-16(18)8-4-15-6-10-17(9-5-14)19(22)12-15/h3,6-7,10-12,24H,4-5,8-9,13H2,1-2H3,(H,23,25) |
| InChIKey | IHTWFNMLSXOHKQ-UHFFFAOYSA-N |
| Mol Weight | 402.33 g/mol |
| Molecular Formula | C21H24BrNO2 |
| Exact Mass | 401.099042 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9u5pP90gFhh |
|---|---|
| Name | (Sp)-4-Bromo-N-(1-hydroxy-2-methyl-2-propyl)-[2.2]paracyclophane-12-carboxamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H24BrNO2 |
| InChI | InChI=1S/C21H24BrNO2/c1-21(2,13-24)23-20(25)18-11-14-3-7-16(18)8-4-15-6-10-17(9-5-14)19(22)12-15/h3,6-7,10-12,24H,4-5,8-9,13H2,1-2H3,(H,23,25) |
| InChIKey | IHTWFNMLSXOHKQ-UHFFFAOYSA-N |
| Molecular Weight | 402.332 g/mol |
| SMILES | N(C(c1c2CCc3cc(c(CCc(c1)cc2)cc3)Br)=O)C(CO)(C)C |
| SPLASH | splash10-0f7k-0911200000-b3b1cd9c657f9dd58280 |
| Source of Spectrum | KD-14-1737-0 |
| Wiley ID | 1636122 |