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(2-S,3-R,5-R)-3-AZIDO-2-BENZOYLOXY-5-HYDROXY-1-(METHOXYCARBONYLMETHYLENE)-CYCLOHEXANE
SpectraBase Compound ID LgIHyLBHZHt
InChI InChI=1S/C16H17N3O5/c1-23-14(21)8-11-7-12(20)9-13(18-19-17)15(11)24-16(22)10-5-3-2-4-6-10/h2-6,8,12-13,15,20H,7,9H2,1H3/b11-8+/t12-,13+,15+/m0/s1
InChIKey HOQGHDWSOWFJRK-UEPJRXRCSA-N
Mol Weight 331.33 g/mol
Molecular Formula C16H17N3O5
Exact Mass 331.116821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A5vNt1DLM1E
Name (2-S,3-R,5-R)-3-AZIDO-2-BENZOYLOXY-5-HYDROXY-1-(METHOXYCARBONYLMETHYLENE)-CYCLOHEXANE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17N3O5
InChI InChI=1S/C16H17N3O5/c1-23-14(21)8-11-7-12(20)9-13(18-19-17)15(11)24-16(22)10-5-3-2-4-6-10/h2-6,8,12-13,15,20H,7,9H2,1H3/b11-8+/t12-,13+,15+/m0/s1
InChIKey HOQGHDWSOWFJRK-UEPJRXRCSA-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 331.328 g/mol
Sample ID 43851
Solvent CDCl3