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1-(2-Fluorobenzyl)-4-(4-methylbenzyl)piperazine oxalate

View entire compound with spectra: 2 NMR

1-(2-Fluorobenzyl)-4-(4-methylbenzyl)piperazine oxalate
SpectraBase Compound ID Io4iXCbe3U7
InChI InChI=1S/C19H23FN2.C2H2O4/c1-16-6-8-17(9-7-16)14-21-10-12-22(13-11-21)15-18-4-2-3-5-19(18)20;3-1(4)2(5)6/h2-9H,10-15H2,1H3;(H,3,4)(H,5,6)
InChIKey FFZYXEFIPGEJCC-UHFFFAOYSA-N
Mol Weight 388.44 g/mol
Molecular Formula C21H25FN2O4
Exact Mass 388.179835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8gxyt4XtfDn
Name 1-(2-Fluorobenzyl)-4-(4-methylbenzyl)piperazine oxalate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.179835452 u
Formula C21H25FN2O4
InChI InChI=1S/C19H23FN2.C2H2O4/c1-16-6-8-17(9-7-16)14-21-10-12-22(13-11-21)15-18-4-2-3-5-19(18)20;3-1(4)2(5)6/h2-9H,10-15H2,1H3;(H,3,4)(H,5,6)
InChIKey FFZYXEFIPGEJCC-UHFFFAOYSA-N
Molecular Weight 388.439 g/mol
SMILES OC(C(O)=O)=O.C1=CC=C(CN2CCN(CC2)CC2=CC=C(C)C=C2)C(F)=C1