![1-(S / R)-[2'-(Dimethylphenylsilyl)ethynyl]-2-(R / S)-(N-(benzylamino)-perhydroindane](/api/spectrum/5aPRXnGyQFE/structure.png?h=300&w=458 "1-(S / R)-[2'-(Dimethylphenylsilyl)ethynyl]-2-(R / S)-(N-(benzylamino)-perhydroindane")
| SpectraBase Compound ID | GeTEXACsPgu |
|---|---|
| InChI | InChI=1S/C26H33NSi/c1-28(2,23-14-7-4-8-15-23)18-17-25-24-16-10-9-13-22(24)19-26(25)27-20-21-11-5-3-6-12-21/h3-8,11-12,14-15,22,24-27H,9-10,13,16,19-20H2,1-2H3/t22-,24-,25?,26?/m0/s1 |
| InChIKey | YMOWEYABDOWHLM-ZMWWESKUSA-N |
| Mol Weight | 387.6 g/mol |
| Molecular Formula | C26H33NSi |
| Exact Mass | 387.238227 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5aPRXnGyQFE |
|---|---|
| Name | 1-(S / R)-[2'-(Dimethylphenylsilyl)ethynyl]-2-(R / S)-(N-(benzylamino)-perhydroindane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 387.238226602 u |
| Formula | C26H33NSi |
| InChI | InChI=1S/C26H33NSi/c1-28(2,23-14-7-4-8-15-23)18-17-25-24-16-10-9-13-22(24)19-26(25)27-20-21-11-5-3-6-12-21/h3-8,11-12,14-15,22,24-27H,9-10,13,16,19-20H2,1-2H3/t22-,24-,25?,26?/m0/s1 |
| InChIKey | YMOWEYABDOWHLM-ZMWWESKUSA-N |
| Molecular Weight | 387.642 g/mol |
| SMILES | C(#C[Si](C=1C=CC=CC1)(C)C)C1C(C[C@]2([C@@]1(CCCC2)[H])[H])NCC1=CC=CC=C1 |