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N-[1-[4-chloro-2-(trifluoromethyl)anilino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-4-methyl-benzamide
SpectraBase Compound ID IusXvTXOney
InChI InChI=1S/C18H12ClF9N2O/c1-9-2-4-10(5-3-9)14(31)30-16(17(23,24)25,18(26,27)28)29-13-7-6-11(19)8-12(13)15(20,21)22/h2-8,29H,1H3,(H,30,31)
InChIKey AHMLMNMLLLHTGU-UHFFFAOYSA-N
Mol Weight 478.75 g/mol
Molecular Formula C18H12ClF9N2O
Exact Mass 478.049444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CC3dqZVg8i
Name N-{1-[4-CHLORO-2-(TRIFLUOROMETHYL)ANILINO]-2,2,2-TRIFLUORO-1-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H12ClF9N2O
InChI InChI=1S/C18H12ClF9N2O/c1-9-2-4-10(5-3-9)14(31)30-16(17(23,24)25,18(26,27)28)29-13-7-6-11(19)8-12(13)15(20,21)22/h2-8,29H,1H3,(H,30,31)
InChIKey AHMLMNMLLLHTGU-UHFFFAOYSA-N
Molecular Weight 478.0492
SMILES N(C(Nc1ccc(Cl)cc1C(F)(F)F)(C(F)(F)F)C(F)(F)F)C(=O)c1ccc(C)cc1
SPLASH splash10-014i-5910000000-a4f6ef43a3611ad55450
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany