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3-Acetyl-9,11-diacetoxyspiro[3-aza-10-oxatricyclo[6.2.1.0(1,6)]undecane-4,1'-cycloheptane]
SpectraBase Compound ID 6FHIMjNmlQ9
InChI InChI=1S/C21H31NO6/c1-13(23)22-12-21-16(11-20(22)8-6-4-5-7-9-20)10-17(18(21)26-14(2)24)19(28-21)27-15(3)25/h16-19H,4-12H2,1-3H3/t16-,17-,18-,19-,21+/m1/s1
InChIKey VSBYMBDIIUKFJU-FKAKKMJLSA-N
Mol Weight 393.48 g/mol
Molecular Formula C21H31NO6
Exact Mass 393.215138 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2sHV6ERJ5Cg
Name 3-ACETYL-9,11-DIACETOXY-SPIRO-[3-AZA-10-OXATRICYCLO-[6.2.1.0-(1.6)]-UNDECANE-4,1'-CYCLOHEPTANE]
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31NO6
InChI InChI=1S/C21H31NO6/c1-13(23)22-12-21-16(11-20(22)8-6-4-5-7-9-20)10-17(18(21)26-14(2)24)19(28-21)27-15(3)25/h16-19H,4-12H2,1-3H3/t16-,17-,18-,19-,21+/m1/s1
InChIKey VSBYMBDIIUKFJU-FKAKKMJLSA-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 393.480 g/mol
Solvent CDCl3
Source File Reference UWVN21810