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JFAFGPKRABBUCE-HDKMNVHJSA-N
SpectraBase Compound ID 5q3g85QA9bh
InChI InChI=1S/C21H21NO6/c1-21(2,3)28-20(25)22-16-12(14(16)18(23)10-6-4-8-26-10)13-15(17(13)22)19(24)11-7-5-9-27-11/h4-9,12-17H,1-3H3/t12-,13-,14-,15-,16-,17-/m1/s1
InChIKey JFAFGPKRABBUCE-HDKMNVHJSA-N
Mol Weight 383.4 g/mol
Molecular Formula C21H21NO6
Exact Mass 383.136887 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 70yeg9DczUL
Name JFAFGPKRABBUCE-HDKMNVHJSA-N
Compound Number 21J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21NO6
InChI InChI=1S/C21H21NO6/c1-21(2,3)28-20(25)22-16-12(14(16)18(23)10-6-4-8-26-10)13-15(17(13)22)19(24)11-7-5-9-27-11/h4-9,12-17H,1-3H3/t12-,13-,14-,15-,16-,17-/m1/s1
InChIKey JFAFGPKRABBUCE-HDKMNVHJSA-N
Literature Reference Author J.KASCHEL,T.F.SCHNEIDER,P.SCHIRMER,C.MAAB,D.STALKE,D.B.WERZ
Literature Reference Citation EUR.J.ORG.CHEM.,2013,4539(2013)
Literature Reference DOI 10.1002/ejoc.201300390
Molecular Weight 383.401 g/mol
Solvent CDCl3
Source File Reference UWBT18970