| SpectraBase Compound ID | AgnT9zYbIQb |
|---|---|
| InChI | InChI=1S/C9H18BrNO2/c1-9(2,3)13-8(12)11-7-5-4-6-10/h4-7H2,1-3H3,(H,11,12) |
| InChIKey | GKGFAEREWWZBKY-UHFFFAOYSA-N |
| Mol Weight | 252.15 g/mol |
| Molecular Formula | C9H18BrNO2 |
| Exact Mass | 251.052092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1RK2yJ4XVaG |
|---|---|
| Name | N-(4-Bromobutyl)carbamic acid, tert-butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.052091822 u |
| Formula | C9H18BrNO2 |
| InChI | InChI=1S/C9H18BrNO2/c1-9(2,3)13-8(12)11-7-5-4-6-10/h4-7H2,1-3H3,(H,11,12) |
| InChIKey | GKGFAEREWWZBKY-UHFFFAOYSA-N |
| Molecular Weight | 252.152 g/mol |
| SMILES | C(Br)CCCNC(=O)OC(C)(C)C |