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MQGWRXYWGDDWNU-YDZHTSKRSA-N

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MQGWRXYWGDDWNU-YDZHTSKRSA-N
SpectraBase Compound ID 2JGK5rwkGmK
InChI InChI=1S/C22H25N3O4/c1-22(18-11-20-19(27-14-28-20)10-16(18)8-9-29-22)12-21(26)24-23-13-15-4-6-17(7-5-15)25(2)3/h4-7,10-11,13H,8-9,12,14H2,1-3H3,(H,24,26)/b23-13+
InChIKey MQGWRXYWGDDWNU-YDZHTSKRSA-N
Mol Weight 395.46 g/mol
Molecular Formula C22H25N3O4
Exact Mass 395.184506 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AmMakf2NpeO
Name MQGWRXYWGDDWNU-YDZHTSKRSA-N
Compound Number 3A(E)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25N3O4
InChI InChI=1S/C22H25N3O4/c1-22(18-11-20-19(27-14-28-20)10-16(18)8-9-29-22)12-21(26)24-23-13-15-4-6-17(7-5-15)25(2)3/h4-7,10-11,13H,8-9,12,14H2,1-3H3,(H,24,26)/b23-13+
InChIKey MQGWRXYWGDDWNU-YDZHTSKRSA-N
Literature Reference Author M.R.L.SANTOS,M.G.DECARVALHO,R.BRAZ-FILHO,E.J.BARREIRO
Literature Reference Citation MAGN.RES.CHEM.,36,533(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199807)36:7<533::aid-omr328>3.0.co;2-v
Molecular Weight 395.458 g/mol
Solvent CDCl3
Source File Reference UWRU1191