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1,4-Dipiperidin-1-yl-2-(4-trifluoromethoxy-phenyl)-butane-1,4-dione
SpectraBase Compound ID CLO7TcRDYh8
InChI InChI=1S/C21H27F3N2O3/c22-21(23,24)29-17-9-7-16(8-10-17)18(20(28)26-13-5-2-6-14-26)15-19(27)25-11-3-1-4-12-25/h7-10,18H,1-6,11-15H2
InChIKey CQWXRTCGLCIXCZ-UHFFFAOYSA-N
Mol Weight 412.45 g/mol
Molecular Formula C21H27F3N2O3
Exact Mass 412.197377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dBlZVEXd2u
Name 1,4-Dipiperidin-1-yl-2-(4-trifluoromethoxy-phenyl)-butane-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27F3N2O3
InChI InChI=1S/C21H27F3N2O3/c22-21(23,24)29-17-9-7-16(8-10-17)18(20(28)26-13-5-2-6-14-26)15-19(27)25-11-3-1-4-12-25/h7-10,18H,1-6,11-15H2
InChIKey CQWXRTCGLCIXCZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200600466
Molecular Weight 412.453 g/mol
SMILES C(=O)(N1CCCCC1)C(c1ccc(cc1)OC(F)(F)F)CC(=O)N1CCCCC1
SPLASH splash10-01t9-5629100000-fcaa94e6c247deb04a85
Source of Spectrum ASC-349-849/SM4-3db
Synonyms 1,4-Di(piperidin-1-yl)-2-(4-(trifluoromethoxy)phenyl)butane-1,4-dione
Wiley ID 1765563