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2-(4-Methoxyphenyl)-2-(2,2,2-trifluoroethoxy)-3,3-dimethyloxetane
SpectraBase Compound ID 7jFpX6I1muv
InChI InChI=1S/C14H17F3O3/c1-12(2)8-19-14(12,20-9-13(15,16)17)10-4-6-11(18-3)7-5-10/h4-7H,8-9H2,1-3H3
InChIKey WVBFJSQRJXLYLP-UHFFFAOYSA-N
Mol Weight 290.28 g/mol
Molecular Formula C14H17F3O3
Exact Mass 290.112979 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Im0yp9g2m1q
Name 2-(4-Methoxyphenyl)-2-(2,2,2-trifluoroethoxy)-3,3-dimethyloxetane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.112978893 u
Formula C14H17F3O3
InChI InChI=1S/C14H17F3O3/c1-12(2)8-19-14(12,20-9-13(15,16)17)10-4-6-11(18-3)7-5-10/h4-7H,8-9H2,1-3H3
InChIKey WVBFJSQRJXLYLP-UHFFFAOYSA-N
Molecular Weight 290.282 g/mol
SMILES C1(C(C)(C)CO1)(OCC(F)(F)F)C=1C=CC(=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.818122