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(5S,7S,1'R)-2,2-DIMETHYL-N-PHENYL-7-(1-PHENYL-PROP-2-EN-YL)-8-THIOXO-3-OXA-1-AZA-BICYCLO-[3.3.0]-OCTANE-7-CARBOXAMIDE
SpectraBase Compound ID aLBIsnXkmT
InChI InChI=1S/C24H26N2O2S/c1-4-20(17-11-7-5-8-12-17)24(21(27)25-18-13-9-6-10-14-18)15-19-16-28-23(2,3)26(19)22(24)29/h4-14,19-20H,1,15-16H2,2-3H3,(H,25,27)/t19-,20+,24-/m0/s1
InChIKey YGZYDHCVHALSMQ-ROKPMTFOSA-N
Mol Weight 406.54 g/mol
Molecular Formula C24H26N2O2S
Exact Mass 406.171499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ga8u7tBHaTK
Name (5S,7S,1'R)-2,2-DIMETHYL-N-PHENYL-7-(1-PHENYL-PROP-2-EN-YL)-8-THIOXO-3-OXA-1-AZA-BICYCLO-[3.3.0]-OCTANE-7-CARBOXAMIDE
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26N2O2S
InChI InChI=1S/C24H26N2O2S/c1-4-20(17-11-7-5-8-12-17)24(21(27)25-18-13-9-6-10-14-18)15-19-16-28-23(2,3)26(19)22(24)29/h4-14,19-20H,1,15-16H2,2-3H3,(H,25,27)/t19-,20+,24-/m0/s1
InChIKey YGZYDHCVHALSMQ-ROKPMTFOSA-N
Literature Reference Author J.K.CHAVDA,P.A.PROCOPIOU,P.N.HORTON,S.J.COLES,M.J.PORTER
Literature Reference Citation EUR.J.ORG.CHEM.,2014,129(2014)
Literature Reference DOI 10.1002/ejoc.201301063
Molecular Weight 406.543 g/mol
Solvent CDCl3
Source File Reference UWIR18183