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6,7,7-Trifluoro-2-oxa-tricyclo[6.3.0.01,6]decan-9-one
SpectraBase Compound ID JoI5TDqCu9l
InChI InChI=1S/C10H11F3O2/c11-9-3-1-5-15-8(9)4-2-6(14)7(8)10(9,12)13/h7H,1-5H2/t7-,8-,9+/m1/s1
InChIKey KOAQPVABAUJEIW-HLTSFMKQSA-N
Mol Weight 220.19 g/mol
Molecular Formula C10H11F3O2
Exact Mass 220.071114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41SADaF4hlA
Name 6,7,7-Trifluoro-2-oxa-tricyclo[6.3.0.01,6]decan-9-one
Alternate Name(s) (4aS,5aS,8aR)-4a,5,5-trifluorooctahydro-6H-cyclopenta[1,4]cyclobuta[1,2-b]pyran-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11F3O2
InChI InChI=1S/C10H11F3O2/c11-9-3-1-5-15-8(9)4-2-6(14)7(8)10(9,12)13/h7H,1-5H2/t7-,8-,9+/m1/s1
InChIKey KOAQPVABAUJEIW-HLTSFMKQSA-N
Literature Reference DOI 10.1002/anie.201204080
Molecular Weight 220.191 g/mol
SMILES C1[C@@]23[C@@](C(C1)=O)(C([C@@]2(CCCO3)F)(F)F)[H]
SPLASH splash10-00di-4980000000-c994f1a709fd26084d4b
Source of Spectrum ACI-51-SMS26-9a
Wiley ID 1780533