(1S*,4R*,7S*)-1,3,3-Trimethyl-5-trifluoromethanesulfonyloxy-7-acetylbicyclo[2.2.2]oct-5-en-2-one

SpectraBase Compound ID	4qHbQFWDkfI
InChI	InChI=1S/C14H17F3O5S/c1-7(18)8-5-9-10(22-23(20,21)14(15,16)17)6-13(8,4)11(19)12(9,2)3/h6,8-9H,5H2,1-4H3/t8-,9+,13+/m1/s1
InChIKey	IDXQZACXSUPLBT-ZDMBXUJBSA-N Google Search
Mol Weight	354.34 g/mol
Molecular Formula	C14H17F3O5S
Exact Mass	354.074879 g/mol

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SpectraBase Spectrum ID	60EicTrFv8Y
Name	(1S,4R,7S*)-1,3,3-Trimethyl-5-trifluoromethanesulfonyloxy-7-acetylbicyclo[2.2.2]oct-5-en-2-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C14H17F3O5S
InChI	InChI=1S/C14H17F3O5S/c1-7(18)8-5-9-10(22-23(20,21)14(15,16)17)6-13(8,4)11(19)12(9,2)3/h6,8-9H,5H2,1-4H3/t8-,9+,13+/m1/s1
InChIKey	IDXQZACXSUPLBT-ZDMBXUJBSA-N
Molecular Weight	354.340 g/mol
SMILES	C(S(OC1=C[C@@]2(C)[C@](C[C@@]1(C(C2=O)(C)C)[H])(C(=O)C)[H])(=O)=O)(F)(F)F
SPLASH	splash10-0006-7490000000-4c5916bbbdeea42a025b
Source of Spectrum	F-69-455-15
Synonyms	(1R,4S,8S)-8-acetyl-4,6,6-trimethyl-5-oxobicyclo[2.2.2]oct-2-en-2-yl trifluoromethanesulfonate
Wiley ID	1594552