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4-[2-(phenethylpropylamino)ethyl]pyrocatechol, dibenzoate(ester), fumarate(1:1)(salt)
SpectraBase Compound ID ViwsuSeBcL
InChI InChI=1S/C33H33NO4.C4H4O4/c1-2-22-34(23-20-26-12-6-3-7-13-26)24-21-27-18-19-30(37-32(35)28-14-8-4-9-15-28)31(25-27)38-33(36)29-16-10-5-11-17-29;5-3(6)1-2-4(7)8/h3-19,25H,2,20-24H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey HVQAADFNEMYXCI-WLHGVMLRSA-N
Mol Weight 623.7 g/mol
Molecular Formula C37H37NO8
Exact Mass 623.251917 g/mol
Parent InChIKey SCXGRAVWHFDJRZ-UHFFFAOYSA-N
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample L. Nedelec, Roussel-Uclaf Research Center, Romainville, France
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Polysol
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample L. NEDELEC, ROUSSEL-UCLAF RESEARCH CENTER, ROMAINVILLE, FRANCE
Technique KBr WAFER
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol
  • PYROCATECHOL, 4-/2-/PHENETHYLPROPYLAMINO/ETHYL/-, DIBENZOATE (ESTER), FUMARATE /1 TO 1/ /SALT/
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