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3,4,5-trimethoxybenzoic acid, ester with alpha-ethyl-4-(3,4,5-trimethoxybenzoyl)-1-piperazineethanol, maleate

View entire compound with spectra: 1 NMR

3,4,5-trimethoxybenzoic acid, ester with alpha-ethyl-4-(3,4,5-trimethoxybenzoyl)-1-piperazineethanol, maleate
SpectraBase Compound ID KLKUlyyOuFY
InChI InChI=1S/C28H38N2O9.C4H4O4/c1-8-20(39-28(32)19-15-23(35-4)26(38-7)24(16-19)36-5)17-29-9-11-30(12-10-29)27(31)18-13-21(33-2)25(37-6)22(14-18)34-3;5-3(6)1-2-4(7)8/h13-16,20H,8-12,17H2,1-7H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey OTEIBXXQWVPSFX-BTJKTKAUSA-N
Mol Weight 662.69 g/mol
Molecular Formula C32H42N2O13
Exact Mass 662.268689 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5A1eHjIzC0
Name 3,4,5-trimethoxybenzoic acid, ester with alpha-ethyl-4-(3,4,5-trimethoxybenzoyl)-1-piperazineethanol, maleate
Source of Sample L. TOLDY, RESEARCH INSTITUTE FOR PHARMACEUTICAL CHEMISTRY, BUDAPEST, HUNGARY
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H42N2O13
InChI InChI=1S/C28H38N2O9.C4H4O4/c1-8-20(39-28(32)19-15-23(35-4)26(38-7)24(16-19)36-5)17-29-9-11-30(12-10-29)27(31)18-13-21(33-2)25(37-6)22(14-18)34-3;5-3(6)1-2-4(7)8/h13-16,20H,8-12,17H2,1-7H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey OTEIBXXQWVPSFX-BTJKTKAUSA-N
Instrument Name Varian A-60
Sadtler NMR Number 3496M
Solvent CDCl3