![t-Butoxycarbonyl-L-valyl-(2S)-2,5-bis[(t-butyl)dimethylsilyloxy]-homoproline - methyl ester](/api/spectrum/6FQHjm3KK3w/structure.png?h=300&w=458 "t-Butoxycarbonyl-L-valyl-(2S)-2,5-bis[(t-butyl)dimethylsilyloxy]-homoproline - methyl ester")
| SpectraBase Compound ID | 52TD6GFNfWq |
|---|---|
| InChI | InChI=1S/C29H58N2O7Si2/c1-19(2)22(30-26(34)36-27(3,4)5)24(32)31-18-20(37-39(13,14)28(6,7)8)17-21(31)23(25(33)35-12)38-40(15,16)29(9,10)11/h19-23H,17-18H2,1-16H3,(H,30,34)/t20?,21?,22-,23-/m0/s1 |
| InChIKey | KHJGMTBTRMVFCG-BBITVKMKSA-N |
| Mol Weight | 603.0 g/mol |
| Molecular Formula | C29H58N2O7Si2 |
| Exact Mass | 602.378255 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6FQHjm3KK3w |
|---|---|
| Name | T-Butoxycarbonyl-L-valyl-(2S)-2,5-bis[(T-butyl)dimethylsilyloxy]-homoproline - methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 602.378255279 u |
| Formula | C29H58N2O7Si2 |
| InChI | InChI=1S/C29H58N2O7Si2/c1-19(2)22(30-26(34)36-27(3,4)5)24(32)31-18-20(37-39(13,14)28(6,7)8)17-21(31)23(25(33)35-12)38-40(15,16)29(9,10)11/h19-23H,17-18H2,1-16H3,(H,30,34)/t20?,21?,22-,23-/m0/s1 |
| InChIKey | KHJGMTBTRMVFCG-BBITVKMKSA-N |
| Molecular Weight | 602.960 g/mol |
| SMILES | C1(N(CC(C1)O[Si](C(C)(C)C)(C)C)C([C@@](NC(OC(C)(C)C)=O)(C(C)C)[H])=O)[C@](O[Si](C(C)(C)C)(C)C)(C(=O)OC)[H] |