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(2-S,3-R,5-R)-3-AZIDO-5-ACETOXY-2-BENZOYLOXY-CYCLOHEXANONE-ETHYLENEDITHIOACETAL
SpectraBase Compound ID Edv52zWYlHy
InChI InChI=1S/C17H19N3O4S2/c1-11(21)23-13-9-14(19-20-18)15(17(10-13)25-7-8-26-17)24-16(22)12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13-,14-,15+/m1/s1
InChIKey WPDIOEVFXOIMCE-KFWWJZLASA-N
Mol Weight 393.48 g/mol
Molecular Formula C17H19N3O4S2
Exact Mass 393.081698 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4H13QutQPsa
Name (2-S,3-R,5-R)-3-AZIDO-5-ACETOXY-2-BENZOYLOXY-CYCLOHEXANONE-ETHYLENEDITHIOACETAL
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H19N3O4S2
InChI InChI=1S/C17H19N3O4S2/c1-11(21)23-13-9-14(19-20-18)15(17(10-13)25-7-8-26-17)24-16(22)12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13-,14-,15+/m1/s1
InChIKey WPDIOEVFXOIMCE-KFWWJZLASA-N
Literature Reference Author I.F.PELYVAS,Z.G.TOTH,G.VEREB,A.BALLA,E.KOVACS,A.GORZSAS,F.SZ TARICSKAI,P.GERGELY
Literature Reference Citation J.MED.CHEM.,44,627(2001)
Literature Reference DOI 10.1021/jm001081c
Molecular Weight 393.476 g/mol
Sample ID 43858
Solvent ACETONE-D6