![2-((1R,5S)-1-((S)-1-((tert-butyldimethylsilyl)oxy)-3-(4-methoxyphenyl)prop-2-yn-1-yl)-6-azabicyclo[3.1.0]hexan-6-yl)isoindoline-1,3-dione](/api/spectrum/Fw3tbJssQKZ/structure.png?h=300&w=458 "2-((1R,5S)-1-((S)-1-((tert-butyldimethylsilyl)oxy)-3-(4-methoxyphenyl)prop-2-yn-1-yl)-6-azabicyclo[3.1.0]hexan-6-yl)isoindoline-1,3-dione")
| SpectraBase Compound ID | GUqQxATEbFB |
|---|---|
| InChI | InChI=1S/C29H34N2O4Si/c1-28(2,3)36(5,6)35-25(18-15-20-13-16-21(34-4)17-14-20)29-19-9-12-24(29)31(29)30-26(32)22-10-7-8-11-23(22)27(30)33/h7-8,10-11,13-14,16-17,24-25H,9,12,19H2,1-6H3/t24-,25?,29+,31?/m0/s1 |
| InChIKey | OBBYOOSIRUYAKG-YREFRSCOSA-N |
| Mol Weight | 502.7 g/mol |
| Molecular Formula | C29H34N2O4Si |
| Exact Mass | 502.228784 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Fw3tbJssQKZ |
|---|---|
| Name | 2-((1R,5S)-1-((S)-1-((tert-butyldimethylsilyl)oxy)-3-(4-methoxyphenyl)prop-2-yn-1-yl)-6-azabicyclo[3.1.0]hexan-6-yl)isoindoline-1,3-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H34N2O4Si |
| InChI | InChI=1S/C29H34N2O4Si/c1-28(2,3)36(5,6)35-25(18-15-20-13-16-21(34-4)17-14-20)29-19-9-12-24(29)31(29)30-26(32)22-10-7-8-11-23(22)27(30)33/h7-8,10-11,13-14,16-17,24-25H,9,12,19H2,1-6H3/t24-,25?,29+,31?/m0/s1 |
| InChIKey | OBBYOOSIRUYAKG-YREFRSCOSA-N |
| Literature Reference DOI | 10.1021/ol901649p |
| Molecular Weight | 502.686 g/mol |
| SMILES | c12C(N(N3[C@@]4([C@]3(CCC4)C(C#Cc3ccc(cc3)OC)O[Si](C(C)(C)C)(C)C)[H])C(c2cccc1)=O)=O |
| SPLASH | splash10-0229-9550000000-785fc1cfd94328d044cf |
| Source of Spectrum | A1-11-4002/SM15-6i |
| Wiley ID | 1757388 |