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3-Benzyl-3-(trifluoromethyl)-1,4-diisopropylpiperazin-2-one
SpectraBase Compound ID 3tqXXS8Za3k
InChI InChI=1S/C18H25F3N2O/c1-13(2)22-10-11-23(14(3)4)17(16(22)24,18(19,20)21)12-15-8-6-5-7-9-15/h5-9,13-14H,10-12H2,1-4H3
InChIKey TWELKYPBBCRWJC-UHFFFAOYSA-N
Mol Weight 342.41 g/mol
Molecular Formula C18H25F3N2O
Exact Mass 342.191898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vMnl2B5PpR
Name 3-Benzyl-3-(trifluoromethyl)-1,4-diisopropylpiperazin-2-one
Alternate Name(s) 3-Benzyl-1,4-diisopropyl-3-(trifluoromethyl)piperazin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25F3N2O
InChI InChI=1S/C18H25F3N2O/c1-13(2)22-10-11-23(14(3)4)17(16(22)24,18(19,20)21)12-15-8-6-5-7-9-15/h5-9,13-14H,10-12H2,1-4H3
InChIKey TWELKYPBBCRWJC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol401041f
Molecular Weight 342.406 g/mol
SMILES C1(C(=O)N(C(C)C)CCN1C(C)C)(C(F)(F)F)Cc1ccccc1
SPLASH splash10-1003-3290000000-76b15e72518888bf41b8
Source of Spectrum A1-15-2726/SMS4-3g
Wiley ID 1748709