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1,1-Difluoro-10-tert-butyl-3,3,7,7-tetrakis(trifluoromethyl)-4,6-benzo-1-ioda-2,8-dioxabicyclo[3.3.0]octane
SpectraBase Compound ID zqJitmdgWc
InChI InChI=1S/C16H11F14IO2/c1-10(2,3)6-4-7-9-8(5-6)12(15(23,24)25,16(26,27)28)33-31(9,29,30)32-11(7,13(17,18)19)14(20,21)22/h4-5H,1-3H3
InChIKey OVUSOJDWVQBJJK-UHFFFAOYSA-N
Mol Weight 628.14 g/mol
Molecular Formula C16H11F14IO2
Exact Mass 627.958019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HE9MM6VlN0h
Name 1,1-Difluoro-10-tert-butyl-3,3,7,7-tetrakis(trifluoromethyl)-4,6-benzo-1-ioda-2,8-dioxabicyclo[3.3.0]octane
CAS Registry Number 136213-44-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11F14IO2
InChI InChI=1S/C16H11F14IO2/c1-10(2,3)6-4-7-9-8(5-6)12(15(23,24)25,16(26,27)28)33-31(9,29,30)32-11(7,13(17,18)19)14(20,21)22/h4-5H,1-3H3
InChIKey OVUSOJDWVQBJJK-UHFFFAOYSA-N
Molecular Weight 628.144 g/mol
SMILES C1(O[I]2(c3c1cc(cc3C(O2)(C(F)(F)F)C(F)(F)F)C(C)(C)C)(F)F)(C(F)(F)F)C(F)(F)F
SPLASH splash10-0bt9-0000095000-13fbfaaa8be87cfa20d7
Source of Spectrum J-56-6566-4
Synonyms 9-tert-Butyl-4,4-difluoro-2,2,6,6-tetrakis(trifluoromethyl)-4-ioda-3,5-dioxatricyclo[5.3.1.0(4,11)]undeca-1(11),7,9-triene
Wiley ID 1411963