SpectraBase Compound ID | Gm7Bre45kyV |
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InChI | InChI=1S/C28H31NO2/c1-2-6-27(29-28(30)31-20-24-7-4-3-5-8-24)26-19-23-14-13-21-9-11-22(12-10-21)15-17-25(26)18-16-23/h3-5,7-12,16,18-19,27H,2,6,13-15,17,20H2,1H3,(H,29,30)/t27-/m0/s1 |
InChIKey | TYOUZKLQKVNEKP-MHZLTWQESA-N |
Mol Weight | 413.56 g/mol |
Molecular Formula | C28H31NO2 |
Exact Mass | 413.235479 g/mol |
SpectraBase Spectrum ID | HSai2yrclnK |
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Name | Benzyl (Rp,S)-[1-([2.2]paracyclophane-4'-yl)butyl]carbamate |
Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C28H31NO2 |
InChI | InChI=1S/C28H31NO2/c1-2-6-27(29-28(30)31-20-24-7-4-3-5-8-24)26-19-23-14-13-21-9-11-22(12-10-21)15-17-25(26)18-16-23/h3-5,7-12,16,18-19,27H,2,6,13-15,17,20H2,1H3,(H,29,30)/t27-/m0/s1 |
InChIKey | TYOUZKLQKVNEKP-MHZLTWQESA-N |
Molecular Weight | 413.561 g/mol |
SMILES | N(C(=O)OCc1ccccc1)[C@](c1c2CCc3ccc(CCc(c1)cc2)cc3)(CCC)[H] |
SPLASH | splash10-01tc-9876600000-2650168995ae8758ffe0 |
Source of Spectrum | F4-40-1294-5c' |
Wiley ID | 1670539 |