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5-Acetyl-10-acetoxyspiro[5-aza-2-oxatricyclo[6.2.1.0(3,9)]undec-3-ene-6,1'-cycloheptane]
SpectraBase Compound ID 3bpguVMiOKi
InChI InChI=1S/2C19H27NO4/c2*1-12(21)20-11-16-17-14(9-15(24-16)18(17)23-13(2)22)10-19(20)7-5-3-4-6-8-19/h2*11,14-15,17-18H,3-10H2,1-2H3/t2*14-,15-,17-,18-/m11/s1
InChIKey BAGSEUFMABPPRA-JTOWERTISA-N
Mol Weight 666.86 g/mol
Molecular Formula C38H54N2O8
Exact Mass 666.388017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1V67YWEQBP3
Name 5-ACETYL-10-ACETOXY-SPIRO-[5-AZA-2-OXATRICYCLO-[6.2.1.0-(3,9)]-UNDEC-3-ENE-6,1'-CYCLOHEPTANE]
Compound Number 14 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H54N2O8
InChI InChI=1S/2C19H27NO4/c2*1-12(21)20-11-16-17-14(9-15(24-16)18(17)23-13(2)22)10-19(20)7-5-3-4-6-8-19/h2*11,14-15,17-18H,3-10H2,1-2H3/t2*14-,15-,17-,18-/m11/s1
InChIKey BAGSEUFMABPPRA-JTOWERTISA-N
Literature Reference Author F.I.ZUBKOV,E.V.NIKITINA,K.F.TURCHIN,G.G.ALEKSANDROV,A.A.SAFR ONOVA,R.S.BORISOV,A.
Literature Reference Citation J.ORG.CHEM.,69,432(2004)
Literature Reference DOI 10.1021/jo0353684
Molecular Weight 666.855 g/mol
Solvent CDCl3
Source File Reference UWVN21811