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CIS-2-(3',4'-DIMETHOXYPHENYL)-3-ACETYLAMINO-7-(N-ACETYL-2''-AMINOETHYL)-1,4-BENZODIOXANE
SpectraBase Compound ID 71gY0OFe9Mo
InChI InChI=1S/C22H26N2O6/c1-13(25)23-10-9-15-5-7-18-20(11-15)29-21(22(30-18)24-14(2)26)16-6-8-17(27-3)19(12-16)28-4/h5-8,11-12,21-22H,9-10H2,1-4H3,(H,23,25)(H,24,26)/t21-,22-/m0/s1
InChIKey CZDWGNXETUXUPW-VXKWHMMOSA-N
Mol Weight 414.46 g/mol
Molecular Formula C22H26N2O6
Exact Mass 414.179087 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JIKsNwPleIU
Name CIS-2-(3',4'-DIMETHOXYPHENYL)-3-ACETYLAMINO-7-(N-ACETYL-2''-AMINOETHYL)-1,4-BENZODIOXANE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H26N2O6
InChI InChI=1S/C22H26N2O6/c1-13(25)23-10-9-15-5-7-18-20(11-15)29-21(22(30-18)24-14(2)26)16-6-8-17(27-3)19(12-16)28-4/h5-8,11-12,21-22H,9-10H2,1-4H3,(H,23,25)(H,24,26)/t21-,22-/m0/s1
InChIKey CZDWGNXETUXUPW-VXKWHMMOSA-N
Literature Reference Author N.NODA,S.KUBOTA,Y.MIYATA,K.MIYAHARA
Literature Reference Citation CHEM.PHARM.BULL.,48,1749(2000)
Literature Reference DOI 10.1248/cpb.48.1749
Molecular Weight 414.458 g/mol
Solvent DMSO-D6
Source File Reference UWVN4701