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Trans-cinnamamide, 3-trifluoromethyl-N-butyl-N-isobutyl-
SpectraBase Compound ID DuTGUqiUvGc
InChI InChI=1S/C18H24F3NO/c1-4-5-11-22(13-14(2)3)17(23)10-9-15-7-6-8-16(12-15)18(19,20)21/h6-10,12,14H,4-5,11,13H2,1-3H3/b10-9+
InChIKey BKQJZBDCKJAHLR-MDZDMXLPSA-N
Mol Weight 327.39 g/mol
Molecular Formula C18H24F3NO
Exact Mass 327.180999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 27MrS8B3vrz
Name Trans-cinnamamide, 3-trifluoromethyl-N-butyl-N-isobutyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.180998885 u
Formula C18H24F3NO
InChI InChI=1S/C18H24F3NO/c1-4-5-11-22(13-14(2)3)17(23)10-9-15-7-6-8-16(12-15)18(19,20)21/h6-10,12,14H,4-5,11,13H2,1-3H3/b10-9+
InChIKey BKQJZBDCKJAHLR-MDZDMXLPSA-N
Molecular Weight 327.391 g/mol
SMILES C1=C(C=C(C=C1)\C=C\C(N(CC(C)C)CCCC)=O)C(F)(F)F