For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,4,5,6-TETRAKIS-(TRIFLUOROMETHYL)-2,7-DIOXATRICYCLO-[6.4.0.0(3,6)]-DODECA-1(8),4,9,11-TETRAENE
SpectraBase Compound ID JtTCvfatAnE
InChI InChI=1S/C14H4F12O2/c15-11(16,17)7-8(12(18,19)20)10(14(24,25)26)9(7,13(21,22)23)27-5-3-1-2-4-6(5)28-10/h1-4H/t9-,10+
InChIKey WBZPSZXWMVAFLT-AOOOYVTPSA-N
Mol Weight 432.16 g/mol
Molecular Formula C14H4F12O2
Exact Mass 432.001967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID OMw93VvBxF
Name (3S,6R)-3,4,5,6-Tetrakis(trifluoromethyl)-2,7dioxatricyclo[6.4.0.0(3,6)]dodeca-1(8),4,9,11-tetraene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H4F12O2
InChI InChI=1S/C14H4F12O2/c15-11(16,17)7-8(12(18,19)20)10(14(24,25)26)9(7,13(21,22)23)27-5-3-1-2-4-6(5)28-10/h1-4H/t9-,10+
InChIKey WBZPSZXWMVAFLT-AOOOYVTPSA-N
Molecular Weight 432.165 g/mol
SMILES [C@]12([C@@](Oc3c(O2)cccc3)(C(F)(F)F)C(=C1C(F)(F)F)C(F)(F)F)C(F)(F)F
SPLASH splash10-001i-0000900000-7d489bc6ffb4999eb0a2
Source of Spectrum KC-0-1462-22
Synonyms (2aR,8aS)-1,2,2a,8a-tetrakis(trifluoromethyl)-2a,8a-dihydrocyclobuta[b][1,4]benzodioxin (2aS,8aR)-1,2,2a,8a-tetrakis(trifluoromethyl)cyclobuta[b][1,4]benzodioxin (2aS,8aR)-1,2,2a,8a-tetrakis(trifluoromethyl)cyclobuta[b][1,4]benzodioxine 3,4,5,6-Tetrakis(trifluoromethyl)-2,7dioxatricyclo[6.4.0.0(3,6)]dodeca-1(8),4,9,11-tetraene (2aR,8aS)-1,2,2a,8a-tetrakis(trifluoromethyl)cyclobuta[b][1,4]benzodioxine
Wiley ID 787970