SpectraBase Compound ID | CRuBz3z2kTw |
---|---|
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-/m1/s1 |
InChIKey | TYOUZKLQKVNEKP-HHHXNRCGSA-N |
Mol Weight | 413.56 g/mol |
Molecular Formula | C28H31NO2 |
Exact Mass | 413.235479 g/mol |
SpectraBase Spectrum ID | 8JhQ7kRwheX |
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Name | Benzyl (Rp,R)-[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-/m1/s1 |
InChIKey | TYOUZKLQKVNEKP-HHHXNRCGSA-N |
Molecular Weight | 413.561 g/mol |
SMILES | N(C(=O)OCc1ccccc1)[C@@](c1c2CCc3ccc(CCc(c1)cc2)cc3)(CCC)[H] |
SPLASH | splash10-03fu-6566900000-8602eb204032cac4ccba |
Source of Spectrum | F4-40-1294-5c |
Wiley ID | 1670540 |