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ZHYFWOJSSHWJMP-UTXCRQHPSA-N
SpectraBase Compound ID A3f4At8FcUF
InChI InChI=1S/C22H21NO8/c1-26-16-4-10(5-17(27-2)21(16)28-3)18-11-6-14-15(31-9-30-14)7-12(11)20(23-25)13-8-29-22(24)19(13)18/h4-7,13,18-19,25H,8-9H2,1-3H3/b23-20-/t13-,18+,19+/m0/s1
InChIKey ZHYFWOJSSHWJMP-UTXCRQHPSA-N
Mol Weight 427.41 g/mol
Molecular Formula C22H21NO8
Exact Mass 427.126717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 317eLXJCbLw
Name ZHYFWOJSSHWJMP-UTXCRQHPSA-N
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20NO8
InChI InChI=1S/C22H21NO8/c1-26-16-4-10(5-17(27-2)21(16)28-3)18-11-6-14-15(31-9-30-14)7-12(11)20(23-25)13-8-29-22(24)19(13)18/h4-7,13,18-19,25H,8-9H2,1-3H3/b23-20-/t13-,18+,19+/m0/s1
InChIKey ZHYFWOJSSHWJMP-UTXCRQHPSA-N
Literature Reference Author M.A.CASTRO,J.M.M.DELCORRAL,M.L.LOPEZ-VAZQUEZ,P.A.GARCIA,A.SA NFELICIANO,M.GORDALI
Literature Reference Citation MAGN.RES.CHEM.,35,808(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199711)35:11<808::aid-omr165>3.0.co;2-l
Molecular Weight 426.403 g/mol
Solvent CDCl3
Source File Reference UWCP3526