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2-(1-Hexynyl)-6-nitro-4-trifluoromethylaniline
SpectraBase Compound ID HhAaK2OaAZU
InChI InChI=1S/C13H13F3N2O2/c1-2-3-4-5-6-9-7-10(13(14,15)16)8-11(12(9)17)18(19)20/h7-8H,2-4,17H2,1H3
InChIKey IZRTXTAYXQHXKN-UHFFFAOYSA-N
Mol Weight 286.25 g/mol
Molecular Formula C13H13F3N2O2
Exact Mass 286.092912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IgTeURQVtd8
Name 2-(1-Hexynyl)-6-nitro-4-trifluoromethylaniline
Alternate Name(s) 2-Hex-1-ynyl-6-nitro-4-(trifluoromethyl)aniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13F3N2O2
InChI InChI=1S/C13H13F3N2O2/c1-2-3-4-5-6-9-7-10(13(14,15)16)8-11(12(9)17)18(19)20/h7-8H,2-4,17H2,1H3
InChIKey IZRTXTAYXQHXKN-UHFFFAOYSA-N
Molecular Weight 286.254 g/mol
SMILES Nc1c(N(=O)=O)cc(C(F)(F)F)cc1C#CCCCC
SPLASH splash10-000i-0090000000-55496d0af1c53233c069
Source of Spectrum F-59-1579-8
Wiley ID 1677261