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4-{2-[(alpha-propylbenzyl)oxy]ethyl}-1-piperazinepropionic acid, maleate(1:2)
SpectraBase Compound ID DtvOv3TE5DZ
InChI InChI=1S/C19H30N2O3.2C4H4O4/c1-2-6-18(17-7-4-3-5-8-17)24-16-15-21-13-11-20(12-14-21)10-9-19(22)23;2*5-3(6)1-2-4(7)8/h3-5,7-8,18H,2,6,9-16H2,1H3,(H,22,23);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey DVDKKYGYPMOIBT-SPIKMXEPSA-N
Mol Weight 566.6 g/mol
Molecular Formula C27H38N2O11
Exact Mass 566.24756 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6AZb90Mhhkf
Name 4-{2-[(alpha-PROPYLBENZYL)OXY]ETHYL}-1-PIPERAZINEPROPIONIC ACID, MALEATE (1:2)
Source of Sample A. DEHNEL, UNIVERSITY OF ORLEANS, ORLEANS CEDEX, FRANCE
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38N2O11
InChI InChI=1S/C19H30N2O3.2C4H4O4/c1-2-6-18(17-7-4-3-5-8-17)24-16-15-21-13-11-20(12-14-21)10-9-19(22)23;2*5-3(6)1-2-4(7)8/h3-5,7-8,18H,2,6,9-16H2,1H3,(H,22,23);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey DVDKKYGYPMOIBT-SPIKMXEPSA-N
Literature Reference J. MED. CHEM. 23, 149(1980) Abstract-Chemical Abstracts= 92, 76453(1980)
Melting Point 163C
Molecular Weight 566.604004
Synonyms 1-PIPERAZINEPROPIONIC ACID, 4-/2-//A-PROPYLBENZYL/OXY/ETHYL/-, MALEATE /1 TO 2/
Technique KBr WAFER