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(1S,5S,6S)-6-(5-Chloro-2,2,3,3,4,4,5,5-octafluoro-pentyl)-3-oxa-bicyclo[3.2.1]octan-2-one
SpectraBase Compound ID 5nMXAIhUGzc
InChI InChI=1S/C12H11ClF8O2/c13-12(20,21)11(18,19)10(16,17)9(14,15)3-6-1-5-2-7(6)4-23-8(5)22/h5-7H,1-4H2/t5-,6-,7+/m0/s1
InChIKey FRKUNDINIRTTOC-LYFYHCNISA-N
Mol Weight 374.66 g/mol
Molecular Formula C12H11ClF8O2
Exact Mass 374.031983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D22AH6SDtOV
Name (1S,5S,6S)-6-(5-Chloro-2,2,3,3,4,4,5,5-octafluoro-pentyl)-3-oxa-bicyclo[3.2.1]octan-2-one
Alternate Name(s) 6-(5-Chloro-2,2,3,3,4,4,5,5-octafluoro-pentyl)-3-oxa-bicyclo[3.2.1]octan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClF8O2
InChI InChI=1S/C12H11ClF8O2/c13-12(20,21)11(18,19)10(16,17)9(14,15)3-6-1-5-2-7(6)4-23-8(5)22/h5-7H,1-4H2/t5-,6-,7+/m0/s1
InChIKey FRKUNDINIRTTOC-LYFYHCNISA-N
Molecular Weight 374.658 g/mol
SMILES C(C(C(F)(F)Cl)(F)F)(C(C[C@]1([C@@]2(C[C@@](C(=O)OC2)(C1)[H])[H])[H])(F)F)(F)F
SPLASH splash10-0159-9017000000-9bff53cb20c219d71306
Source of Spectrum F-66-7292-3ac
Wiley ID 1681140