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1-[4-(2-Fluoroethoxy)phenoxy]-3-[4-[3-(3-pyridyl)-2-pyridyl]piperazin-1-yl]propan-2-ol
SpectraBase Compound ID K4IILUzwYQj
InChI InChI=1S/C25H29FN4O3/c26-9-16-32-22-5-7-23(8-6-22)33-19-21(31)18-29-12-14-30(15-13-29)25-24(4-2-11-28-25)20-3-1-10-27-17-20/h1-8,10-11,17,21,31H,9,12-16,18-19H2
InChIKey DZZUOQSXYZQTPD-UHFFFAOYSA-N
Mol Weight 452.53 g/mol
Molecular Formula C25H29FN4O3
Exact Mass 452.222369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Huh9gLhTotq
Name 1-[4-(2-Fluoroethoxy)phenoxy]-3-[4-[3-(3-pyridyl)-2-pyridyl]piperazin-1-yl]propan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29FN4O3
InChI InChI=1S/C25H29FN4O3/c26-9-16-32-22-5-7-23(8-6-22)33-19-21(31)18-29-12-14-30(15-13-29)25-24(4-2-11-28-25)20-3-1-10-27-17-20/h1-8,10-11,17,21,31H,9,12-16,18-19H2
InChIKey DZZUOQSXYZQTPD-UHFFFAOYSA-N
Instrument Name HP6890-5973 MSD
Ionization Type EI
Molecular Weight 452.530 g/mol
SMILES OC(COc1ccc(OCCF)cc1)CN1CCN(CC1)c1ncccc1-c1cnccc1
SPLASH splash10-0ue9-0960200000-96dcd998efc757673387
Source of Spectrum WO2012159662A1
Wiley ID 1846930