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4-{2-[(p-fluorophenyl)phenylmethoxy]ethyl}-1-piperazinepropionic acid, maleate(1:2)
SpectraBase Compound ID JGQRT1BjkyZ
InChI InChI=1S/C22H27FN2O3.2C4H4O4/c23-20-8-6-19(7-9-20)22(18-4-2-1-3-5-18)28-17-16-25-14-12-24(13-15-25)11-10-21(26)27;2*5-3(6)1-2-4(7)8/h1-9,22H,10-17H2,(H,26,27);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey GBKXTVMZPAEDSP-SPIKMXEPSA-N
Mol Weight 618.61 g/mol
Molecular Formula C30H35FN2O11
Exact Mass 618.222488 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID GIa3DzxUJac
Name 4-{2-[(p-FLUOROPHENYL)PHENYLMETHOXY]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 C30H35FN2O11
InChI InChI=1S/C22H27FN2O3.2C4H4O4/c23-20-8-6-19(7-9-20)22(18-4-2-1-3-5-18)28-17-16-25-14-12-24(13-15-25)11-10-21(26)27;2*5-3(6)1-2-4(7)8/h1-9,22H,10-17H2,(H,26,27);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey GBKXTVMZPAEDSP-SPIKMXEPSA-N
Literature Reference J. MED. CHEM. 23, 149(1980) Abstract-Chemical Abstracts= 92, 76453(1980)
Melting Point 173C
Molecular Weight 618.612976
Synonyms 1-PIPERAZINEPROPIONIC ACID, 4-/2-//P-FLUOROPHENYL/PHENYLMETHOXY/- ETHYL/-, MALEATE /1 TO 2/
Technique KBr WAFER