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Piperazine, 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(4-fluorobenzoyl)-
SpectraBase Compound ID Gc8WAbnPzjT
InChI InChI=1S/C18H14F4N4O5/c19-13-3-1-11(2-4-13)17(27)24-7-5-23(6-8-24)16-14(25(28)29)9-12(18(20,21)22)10-15(16)26(30)31/h1-4,9-10H,5-8H2
InChIKey ZDXZUXVTTWGRFH-UHFFFAOYSA-N
Mol Weight 442.33 g/mol
Molecular Formula C18H14F4N4O5
Exact Mass 442.090032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58VcnyPNIMg
Name Piperazine, 1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(4-fluorobenzoyl)-
Alternate Name(s) [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-(4-fluorophenyl)methanone [4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(4-fluorophenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14F4N4O5
InChI InChI=1S/C18H14F4N4O5/c19-13-3-1-11(2-4-13)17(27)24-7-5-23(6-8-24)16-14(25(28)29)9-12(18(20,21)22)10-15(16)26(30)31/h1-4,9-10H,5-8H2
InChIKey ZDXZUXVTTWGRFH-UHFFFAOYSA-N
Molecular Weight 442.327 g/mol
SMILES c1(c(c(N(=O)=O)cc(C(F)(F)F)c1)N1CCN(C(c2ccc(cc2)F)=O)CC1)N(=O)=O
SPLASH splash10-00di-5910000000-421b1daac2a384729184
Source of Spectrum IY-1-4646-2
Wiley ID 1654445