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(2-(4-(bis(4-Fluorophenyl)methyl)piperazin-1-yl)phenyl)methanol, acetate

View entire compound with spectra: 1 NMR

(2-(4-(bis(4-Fluorophenyl)methyl)piperazin-1-yl)phenyl)methanol, acetate
SpectraBase Compound ID K6FcfNsk5A3
InChI InChI=1S/C26H26F2N2O2/c1-19(31)32-18-22-4-2-3-5-25(22)29-14-16-30(17-15-29)26(20-6-10-23(27)11-7-20)21-8-12-24(28)13-9-21/h2-13,26H,14-18H2,1H3
InChIKey VMNQJOLRNRLEQY-UHFFFAOYSA-N
Mol Weight 436.5 g/mol
Molecular Formula C26H26F2N2O2
Exact Mass 436.196234 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2j0g9OMVUCJ
Name (2-(4-(bis(4-Fluorophenyl)methyl)piperazin-1-yl)phenyl)methanol, acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.196234409 u
Formula C26H26F2N2O2
InChI InChI=1S/C26H26F2N2O2/c1-19(31)32-18-22-4-2-3-5-25(22)29-14-16-30(17-15-29)26(20-6-10-23(27)11-7-20)21-8-12-24(28)13-9-21/h2-13,26H,14-18H2,1H3
InChIKey VMNQJOLRNRLEQY-UHFFFAOYSA-N
Molecular Weight 436.503 g/mol
SMILES C1(F)=CC=C(C=C1)C(N1CCN(CC1)C1=C(C=CC=C1)COC(C)=O)C1=CC=C(C=C1)F