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5,6,6-Trifluoro-2-oxa-tricyclo[5.3.0.01,5]decan-8-one
SpectraBase Compound ID AVIPpgmUYEp
InChI InChI=1S/C9H9F3O2/c10-8-3-4-14-7(8)2-1-5(13)6(7)9(8,11)12/h6H,1-4H2/t6-,7-,8+/m1/s1
InChIKey PGHIXDPNOIVUGO-PRJMDXOYSA-N
Mol Weight 206.16 g/mol
Molecular Formula C9H9F3O2
Exact Mass 206.055464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EEfgkpA7dCI
Name 5,6,6-Trifluoro-2-oxa-tricyclo[5.3.0.01,5]decan-8-one
Alternate Name(s) (3aS,4aS,7aR)-3a,4,4-trifluorohexahydrocyclopenta[1,4]cyclobuta[1,2-b]furan-5(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9F3O2
InChI InChI=1S/C9H9F3O2/c10-8-3-4-14-7(8)2-1-5(13)6(7)9(8,11)12/h6H,1-4H2/t6-,7-,8+/m1/s1
InChIKey PGHIXDPNOIVUGO-PRJMDXOYSA-N
Literature Reference DOI 10.1002/anie.201204080
Molecular Weight 206.164 g/mol
SMILES C1([C@]2([C@@]3(CCC2=O)OCC[C@@]13F)[H])(F)F
SPLASH splash10-0pb9-4950000000-71b7b1c6a76ed26138c9
Source of Spectrum ACI-51-SMS8-5a
Wiley ID 1780523