![2-((1R,6S)-1-((S)-1-((tert-butyldimethylsilyl)oxy)oct-2-yn-1-yl)-7-azabicyclo[4.1.0]heptan-7-yl)isoindoline-1,3-dione](/api/spectrum/En5fNB1kdzC/structure.png?h=300&w=458 "2-((1R,6S)-1-((S)-1-((tert-butyldimethylsilyl)oxy)oct-2-yn-1-yl)-7-azabicyclo[4.1.0]heptan-7-yl)isoindoline-1,3-dione")
| SpectraBase Compound ID | KhypYuQ3HBZ |
|---|---|
| InChI | InChI=1S/C28H40N2O3Si/c1-7-8-9-10-11-19-24(33-34(5,6)27(2,3)4)28-20-15-14-18-23(28)30(28)29-25(31)21-16-12-13-17-22(21)26(29)32/h12-13,16-17,23-24H,7-10,14-15,18,20H2,1-6H3/t23-,24?,28+,30?/m0/s1 |
| InChIKey | LHBQBHHEPACQMW-GFGGWIFVSA-N |
| Mol Weight | 480.7 g/mol |
| Molecular Formula | C28H40N2O3Si |
| Exact Mass | 480.28082 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | En5fNB1kdzC |
|---|---|
| Name | 2-((1R,6S)-1-((S)-1-((tert-butyldimethylsilyl)oxy)oct-2-yn-1-yl)-7-azabicyclo[4.1.0]heptan-7-yl)isoindoline-1,3-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H40N2O3Si |
| InChI | InChI=1S/C28H40N2O3Si/c1-7-8-9-10-11-19-24(33-34(5,6)27(2,3)4)28-20-15-14-18-23(28)30(28)29-25(31)21-16-12-13-17-22(21)26(29)32/h12-13,16-17,23-24H,7-10,14-15,18,20H2,1-6H3/t23-,24?,28+,30?/m0/s1 |
| InChIKey | LHBQBHHEPACQMW-GFGGWIFVSA-N |
| Literature Reference DOI | 10.1021/ol901649p |
| Molecular Weight | 480.724 g/mol |
| SMILES | c12ccccc2C(N(N2[C@]3(CCCC[C@@]23C(C#CCCCCC)O[Si](C(C)(C)C)(C)C)[H])C1=O)=O |
| SPLASH | splash10-0uk9-9334000000-f08f7c5d678c8a34736f |
| Source of Spectrum | A1-11-4002/SM12-6d |
| Wiley ID | 1757383 |