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3,3'-(Perfluoroprop-1-ene-1,1-diyl)bis((trifluoromethyl)benzene)
SpectraBase Compound ID LTRkafiZomd
InChI InChI=1S/C17H8F10/c18-14(17(25,26)27)13(9-3-1-5-11(7-9)15(19,20)21)10-4-2-6-12(8-10)16(22,23)24/h1-8H
InChIKey HUXIZDIWJCKPIL-UHFFFAOYSA-N
Mol Weight 402.24 g/mol
Molecular Formula C17H8F10
Exact Mass 402.046632 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3pbe7YTg4Vq
Name 3,3'-(Perfluoroprop-1-ene-1,1-diyl)bis((trifluoromethyl)benzene)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.046631888 u
Formula C17H8F10
InChI InChI=1S/C17H8F10/c18-14(17(25,26)27)13(9-3-1-5-11(7-9)15(19,20)21)10-4-2-6-12(8-10)16(22,23)24/h1-8H
InChIKey HUXIZDIWJCKPIL-UHFFFAOYSA-N
Molecular Weight 402.235 g/mol
SMILES C(=C(C(F)(F)F)F)(C1=CC=CC(=C1)C(F)(F)F)C1=CC=CC(=C1)C(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.950706