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1,2-Dicyano-4,5-bis(1,1,1-trifluoroethoxymethyl)benzene

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1,2-Dicyano-4,5-bis(1,1,1-trifluoroethoxymethyl)benzene
SpectraBase Compound ID 1hTfQuGtQET
InChI InChI=1S/C14H10F6N2O2/c15-13(16,17)7-23-5-11-1-9(3-21)10(4-22)2-12(11)6-24-8-14(18,19)20/h1-2H,5-8H2
InChIKey LNTNBDVKXNWTRP-UHFFFAOYSA-N
Mol Weight 352.24 g/mol
Molecular Formula C14H10F6N2O2
Exact Mass 352.064647 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8HJll3onDd4
Name 1,2-Dicyano-4,5-bis(1,1,1-trifluoroethoxymethyl)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.064646546 u
Formula C14H10F6N2O2
InChI InChI=1S/C14H10F6N2O2/c15-13(16,17)7-23-5-11-1-9(3-21)10(4-22)2-12(11)6-24-8-14(18,19)20/h1-2H,5-8H2
InChIKey LNTNBDVKXNWTRP-UHFFFAOYSA-N
Molecular Weight 352.236 g/mol
SMILES C(F)(F)(F)COCC=1C=C(C#N)C(=CC1COCC(F)(F)F)C#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.823602