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(+)-N1-[(1S)-1-PHENYLETHYL]-1-[(S)-SPIROBRASSININ]-CARBOXAMIDE
SpectraBase Compound ID 3rVZE9pWdmb
InChI InChI=1S/C20H19N3O2S2/c1-13(14-8-4-3-5-9-14)22-18(25)23-16-11-7-6-10-15(16)20(17(23)24)12-21-19(26-2)27-20/h3-11,13H,12H2,1-2H3,(H,22,25)/t13-,20+/m0/s1
InChIKey ZBKBKMPPPCTHEK-RNODOKPDSA-N
Mol Weight 397.51 g/mol
Molecular Formula C20H19N3O2S2
Exact Mass 397.091869 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2mOBbXfTi30
Name (+)-N1-[(1S)-1-PHENYLETHYL]-1-[(S)-SPIROBRASSININ]-CARBOXAMIDE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19N3O2S2
InChI InChI=1S/C20H19N3O2S2/c1-13(14-8-4-3-5-9-14)22-18(25)23-16-11-7-6-10-15(16)20(17(23)24)12-21-19(26-2)27-20/h3-11,13H,12H2,1-2H3,(H,22,25)/t13-,20+/m0/s1
InChIKey ZBKBKMPPPCTHEK-RNODOKPDSA-N
Literature Reference Author M.SUCHY,P.KUTSCHY,K.MONDE,H.GOTO,N.HARADA,M.TAKAGUSI,M.DZURI LLA,E.BALENTOVA
Literature Reference Citation J.ORG.CHEM.,66,3940(2001)
Literature Reference DOI 10.1021/jo0155052
Molecular Weight 397.510 g/mol
Solvent CDCl3
Source File Reference UWMS27356