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1-Tert-butyloxy-18,18,18-trifluorooctadecane

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

1-Tert-butyloxy-18,18,18-trifluorooctadecane
SpectraBase Compound ID 34pUXeAUEGa
InChI InChI=1S/C22H43F3O/c1-21(2,3)26-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-22(23,24)25/h4-20H2,1-3H3
InChIKey JLYUFOJJFADWNL-UHFFFAOYSA-N
Mol Weight 380.6 g/mol
Molecular Formula C22H43F3O
Exact Mass 380.3266 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E32sPR2OgrN
Name 1-Tert-butyloxy-18,18,18-trifluorooctadecane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.326600493 u
Formula C22H43F3O
InChI InChI=1S/C22H43F3O/c1-21(2,3)26-20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-22(23,24)25/h4-20H2,1-3H3
InChIKey JLYUFOJJFADWNL-UHFFFAOYSA-N
Molecular Weight 380.580 g/mol
SMILES C(CCCCCCCCCCCCCCCCC(F)(F)F)OC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.925791