![Allyl N-[(1R,2R,6S)-2-[tert-butyl(diphenyl)silyl]oxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-4-yl]carbamate](/api/spectrum/7qyCG5jz0lq/structure.png?h=300&w=458 "Allyl N-[(1R,2R,6S)-2-[tert-butyl(diphenyl)silyl]oxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-4-yl]carbamate")
| SpectraBase Compound ID | 4au4TXJNOG4 |
|---|---|
| InChI | InChI=1S/C26H29NO5Si/c1-5-16-30-25(29)27-20-17-21(23-24(31-23)22(20)28)32-33(26(2,3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h5-15,17,21,23-24H,1,16H2,2-4H3,(H,27,29)/t21-,23+,24-/m1/s1 |
| InChIKey | FJWNHIFSVSQBSG-YFNKSVMNSA-N |
| Mol Weight | 463.61 g/mol |
| Molecular Formula | C26H29NO5Si |
| Exact Mass | 463.1815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7qyCG5jz0lq |
|---|---|
| Name | Allyl N-[(1R,2R,6S)-2-[tert-butyl(diphenyl)silyl]oxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-4-yl]carbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 463.181499568 u |
| Formula | C26H29NO5Si |
| InChI | InChI=1S/C26H29NO5Si/c1-5-16-30-25(29)27-20-17-21(23-24(31-23)22(20)28)32-33(26(2,3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h5-15,17,21,23-24H,1,16H2,2-4H3,(H,27,29)/t21-,23+,24-/m1/s1 |
| InChIKey | FJWNHIFSVSQBSG-YFNKSVMNSA-N |
| Molecular Weight | 463.605 g/mol |
| SMILES | [C@]12([C@]([C@](O[Si](C(C)(C)C)(C3=CC=CC=C3)C3=CC=CC=C3)(C=C(C2=O)NC(=O)OCC=C)[H])(O1)[H])[H] |