| SpectraBase Compound ID | 1yCrmJ5l3Yb |
|---|---|
| InChI | InChI=1S/C13H25NO3/c1-7-8-10(15)11(9(2)3)14-12(16)17-13(4,5)6/h7,9-11,15H,1,8H2,2-6H3,(H,14,16) |
| InChIKey | NTUPQJOONVOZIM-UHFFFAOYSA-N |
| Mol Weight | 243.35 g/mol |
| Molecular Formula | C13H25NO3 |
| Exact Mass | 243.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JEmz8YsfrhE |
|---|---|
| Name | (2S,4rs)-3-(Tert-butoxycarbonylamino)-2-methyl-6-hepten-4-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.183443666 u |
| Formula | C13H25NO3 |
| InChI | InChI=1S/C13H25NO3/c1-7-8-10(15)11(9(2)3)14-12(16)17-13(4,5)6/h7,9-11,15H,1,8H2,2-6H3,(H,14,16) |
| InChIKey | NTUPQJOONVOZIM-UHFFFAOYSA-N |
| Molecular Weight | 243.347 g/mol |
| SMILES | CC(C(C(CC=C)O)NC(=O)OC(C)(C)C)C |