For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzamide, 2-(4-trifluoromethyl-2-nitrophenoxy-N-(3-trifluoromethylphenyl)-
SpectraBase Compound ID 9zpof0R2hQ8
InChI InChI=1S/C21H12F6N2O4/c22-20(23,24)12-4-3-5-14(10-12)28-19(30)15-6-1-2-7-17(15)33-18-9-8-13(21(25,26)27)11-16(18)29(31)32/h1-11H,(H,28,30)
InChIKey XHVLKUFOOVDVLP-UHFFFAOYSA-N
Mol Weight 470.33 g/mol
Molecular Formula C21H12F6N2O4
Exact Mass 470.070126 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5wM91ITDvWV
Name Benzamide, 2-(4-trifluoromethyl-2-nitrophenoxy-N-(3-trifluoromethylphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.070125848 u
Formula C21H12F6N2O4
InChI InChI=1S/C21H12F6N2O4/c22-20(23,24)12-4-3-5-14(10-12)28-19(30)15-6-1-2-7-17(15)33-18-9-8-13(21(25,26)27)11-16(18)29(31)32/h1-11H,(H,28,30)
InChIKey XHVLKUFOOVDVLP-UHFFFAOYSA-N
Molecular Weight 470.327 g/mol
SMILES C1(N(=O)=O)=C(OC=2C(C(NC3=CC=CC(C(F)(F)F)=C3)=O)=CC=CC2)C=CC(=C1)C(F)(F)F