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(+)-TERT.-BUTYL-(R)-4-BENZYL-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZINE-1-CARBOXYLATE

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(+)-TERT.-BUTYL-(R)-4-BENZYL-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZINE-1-CARBOXYLATE
SpectraBase Compound ID K5fbPdorSVP
InChI InChI=1S/C22H35N3O2/c1-18(23-12-8-9-13-23)20-17-25(21(26)27-22(2,3)4)15-14-24(20)16-19-10-6-5-7-11-19/h5-7,10-11,18,20H,8-9,12-17H2,1-4H3/t18-,20+/m0/s1
InChIKey HJCOAKBBWKHLBX-AZUAARDMSA-N
Mol Weight 373.5 g/mol
Molecular Formula C22H35N3O2
Exact Mass 373.272927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HzektPEk1wB
Name (+)-TERT.-BUTYL-(R)-4-BENZYL-3-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZINE-1-CARBOXYLATE
Compound Number (R,S)-10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H35N3O2
InChI InChI=1S/C22H35N3O2/c1-18(23-12-8-9-13-23)20-17-25(21(26)27-22(2,3)4)15-14-24(20)16-19-10-6-5-7-11-19/h5-7,10-11,18,20H,8-9,12-17H2,1-4H3/t18-,20+/m0/s1
InChIKey HJCOAKBBWKHLBX-AZUAARDMSA-N
Literature Reference Author S.SOUKARA,C.A.MAIER,U.PREDOIU,A.EHRET,R.JACKISCH,B.WUENSCH
Literature Reference Citation J.MED.CHEM.,44,2814(2001)
Literature Reference DOI 10.1021/jm0108395
Molecular Weight 373.539 g/mol
Sample ID 45022
Solvent DMSO-D6