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3-[3,3-Difluoro-2-(trifluoromethyl)bicyclo[2.2.1]hept-5-en-2-yl]-5,5-bis(trifluoromethyl)-1,4,2-dioxazole
SpectraBase Compound ID 7zGTHNrdoSw
InChI InChI=1S/C12H6F11NO2/c13-8(14)5-2-1-4(3-5)7(8,10(15,16)17)6-24-26-9(25-6,11(18,19)20)12(21,22)23/h1-2,4-5H,3H2/t4-,5+,7-/m1/s1
InChIKey GXNWFGZDEAJYLU-JCGDXUMPSA-N
Mol Weight 405.17 g/mol
Molecular Formula C12H6F11NO2
Exact Mass 405.022288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmV0kyeGN3U
Name 3-[3,3-Difluoro-2-(trifluoromethyl)bicyclo[2.2.1]hept-5-en-2-yl]-5,5-bis(trifluoromethyl)-1,4,2-dioxazole
CAS Registry Number 94637-19-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6F11NO2
InChI InChI=1S/C12H6F11NO2/c13-8(14)5-2-1-4(3-5)7(8,10(15,16)17)6-24-26-9(25-6,11(18,19)20)12(21,22)23/h1-2,4-5H,3H2/t4-,5+,7-/m1/s1
InChIKey GXNWFGZDEAJYLU-JCGDXUMPSA-N
Molecular Weight 405.167 g/mol
SMILES C1=C[C@]2(C[C@@]1([C@](C2(F)F)(C1=NOC(C(F)(F)F)(C(F)(F)F)O1)C(F)(F)F)[H])[H]
SPLASH splash10-014i-9306100000-693876a78673cdef4ba9
Source of Spectrum W5-1989-35695-29841
Synonyms 2,2-Difluoro-3-trifluoromethyl-3-[5',5'-bis(trifluoromethyl)-1',4',2'-dioxazolin-3'-yl]bicyclo(2.2.1)hept-5-ene 3-[3,3-bis(fluoranyl)-2-(trifluoromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-5,5-bis(trifluoromethyl)-1,4,2-dioxazole 3-[3,3-difluoro-2-(trifluoromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-5,5-bis(trifluoromethyl)-1,4,2-dioxazole
Wiley ID 1371640